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Identification Taxonomy Ontology Physical properties Spectra Biological properties Concentrations Links References enzymes (3) Show 3 proteins XML

Record Information

Version

5.0

Status

Expected but not Quantified

Creation Date

2012-09-11 20:24:19 UTC

Update Date

2022-03-07 02:54:30 UTC

HMDB ID

HMDB0035426

Secondary Accession Numbers

HMDB35426

Metabolite Identification

Common Name

(S)-Naringenin 8-C-(2''-rhamnosylglucoside)

Description

(S)-Naringenin 8-C-(2''-rhamnosylglucoside) belongs to the class of organic compounds known as flavonoid 8-c-glycosides. Flavonoid 8-C-glycosides are compounds containing a carbohydrate moiety which is C-glycosidically linked to 8-position of a 2-phenylchromen-4-one flavonoid backbone (S)-Naringenin 8-C-(2''-rhamnosylglucoside) has been detected, but not quantified in, fruits. This could make (S)-naringenin 8-C-(2''-rhamnosylglucoside) a potential biomarker for the consumption of these foods. Based on a literature review very few articles have been published on (S)-Naringenin 8-C-(2''-rhamnosylglucoside).

Structure

MOL 3D MOL SDF 3D SDF PDB 3D PDB SMILES InChI


  Mrv0541 05061308262D          

 41 45  0  0  0  0            999 V2000
   -0.7145   -3.7125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0013   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7158    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7158   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4302   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -2.8875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -2.8875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0013   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4302   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579   -2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289   -2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -2.8875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.4289   -2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.5724   -3.7125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1447   -1.6500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    0.7145   -0.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724    2.0625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1434   -2.8875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.1434   -1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.7145   -0.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -2.4750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -0.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579   -1.6500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  4  2  1  0  0  0  0
  5  3  2  0  0  0  0
  9  1  1  0  0  0  0
 10  2  2  0  0  0  0
 10  3  1  0  0  0  0
 11  4  2  0  0  0  0
 11  5  1  0  0  0  0
 12  6  2  0  0  0  0
 13  6  1  0  0  0  0
 14  7  1  0  0  0  0
 15  7  1  0  0  0  0
 15 10  1  0  0  0  0
 16  8  1  0  0  0  0
 17 12  1  0  0  0  0
 17 14  1  0  0  0  0
 18 13  2  0  0  0  0
 19  9  1  0  0  0  0
 20 16  1  0  0  0  0
 21 19  1  0  0  0  0
 22 20  1  0  0  0  0
 23 21  1  0  0  0  0
 24 17  2  0  0  0  0
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 26 22  1  0  0  0  0
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 27 23  1  0  0  0  0
 28  8  1  0  0  0  0
 29 11  1  0  0  0  0
 30 12  1  0  0  0  0
 31 13  1  0  0  0  0
 32 14  2  0  0  0  0
 33 19  1  0  0  0  0
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 36 22  1  0  0  0  0
 37 23  1  0  0  0  0
 38  9  1  0  0  0  0
 38 27  1  0  0  0  0
 39 15  1  0  0  0  0
 39 24  1  0  0  0  0
 40 16  1  0  0  0  0
 40 25  1  0  0  0  0
 41 26  1  0  0  0  0
 41 27  1  0  0  0  0
M  END

HMDB0035426
     RDKit          3D
(S)-Naringenin 8-C-(2''-rhamnosylglucoside)
 73 77  0  0  0  0  0  0  0  0999 V2000
    3.2972    4.2541    1.0110 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4927    2.7419    1.1418 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2954    2.0710    1.1769 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1273    1.0715    0.2689 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8992    0.4475    0.5057 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0977   -0.8733    0.5596 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3118   -1.8327   -0.2226 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7501   -1.4856   -1.1293 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5997   -1.9732   -2.4524 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6439   -2.5677   -2.7804 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5895   -1.8777   -3.3774 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7871   -1.2878   -3.0180 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8578   -1.1384   -3.9028 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9793   -0.8075   -1.7398 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9528   -0.9134   -0.8227 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2302   -0.3943    0.4409 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5045   -0.1507    0.9741 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8773    1.2994    1.0109 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9847    2.3262    0.7065 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3957    3.6367    0.7140 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6988    3.9185    1.0238 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1665    5.2363    1.0391 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5939    2.9158    1.3304 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1848    1.5934    1.3256 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6208   -0.8000    0.1235 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2962   -0.3281   -1.2778 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9620    0.3494   -2.0180 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0137   -3.0041   -0.5053 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9374   -3.3950    0.4167 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7092   -4.9077    0.6218 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8137   -5.6220   -0.5476 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9469   -2.8015    1.7669 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5543   -3.7321    2.7250 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3031   -1.4574    1.9752 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0646   -1.5531    2.5671 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2746    1.6463   -1.1294 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9367    0.6969   -2.0976 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7363    2.0415   -1.2496 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4042    0.9474   -1.8575 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4161    2.2769    0.0521 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1800    1.2144    0.5138 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9934    4.7133    1.9783 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5932    4.4973    0.2055 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2895    4.6701    0.7528 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0083    2.6074    2.1117 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9496    0.3116    0.3144 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2246   -1.0610    0.1795 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3711   -2.3256    0.6971 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7519   -2.8699   -3.7379 H   0  0  0  0  0  0  0  0  0  0  0  0
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   -4.4916   -1.8892    0.2221 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5888   -0.4563    0.4427 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9494   -3.3606   -0.0943 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4614   -5.2749    1.3778 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7279   -5.0745    1.0880 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3123   -6.4554   -0.3654 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0599   -2.6329    2.0121 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2958   -4.0401    3.2955 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9574   -0.7678    2.5613 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1520   -0.6504    2.9778 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6409    2.5293   -1.2342 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7396    0.3118   -2.5399 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8370    2.8660   -1.9618 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6149    0.2809   -1.1400 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1516    3.1228   -0.0974 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1352    1.3249    0.2706 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  2  0
  9 10  1  0
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 34  6  1  0
 15  8  1  0
 24 18  1  0
 26 14  1  0
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  4 46  1  0
  6 47  1  0
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 34 66  1  0
 35 67  1  0
 36 68  1  0
 37 69  1  0
 38 70  1  0
 39 71  1  0
 40 72  1  0
 41 73  1  0
M  END


  Mrv0541 05061308262D          

 41 45  0  0  0  0            999 V2000
   -0.7145   -3.7125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0013   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7158    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7158   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4302   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.1434   -3.7125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1434   -1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -2.8875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -0.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -2.4750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -0.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579   -1.6500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  4  2  1  0  0  0  0
  5  3  2  0  0  0  0
  9  1  1  0  0  0  0
 10  2  2  0  0  0  0
 10  3  1  0  0  0  0
 11  4  2  0  0  0  0
 11  5  1  0  0  0  0
 12  6  2  0  0  0  0
 13  6  1  0  0  0  0
 14  7  1  0  0  0  0
 15  7  1  0  0  0  0
 15 10  1  0  0  0  0
 16  8  1  0  0  0  0
 17 12  1  0  0  0  0
 17 14  1  0  0  0  0
 18 13  2  0  0  0  0
 19  9  1  0  0  0  0
 20 16  1  0  0  0  0
 21 19  1  0  0  0  0
 22 20  1  0  0  0  0
 23 21  1  0  0  0  0
 24 17  2  0  0  0  0
 24 18  1  0  0  0  0
 25 18  1  0  0  0  0
 26 22  1  0  0  0  0
 26 25  1  0  0  0  0
 27 23  1  0  0  0  0
 28  8  1  0  0  0  0
 29 11  1  0  0  0  0
 30 12  1  0  0  0  0
 31 13  1  0  0  0  0
 32 14  2  0  0  0  0
 33 19  1  0  0  0  0
 34 20  1  0  0  0  0
 35 21  1  0  0  0  0
 36 22  1  0  0  0  0
 37 23  1  0  0  0  0
 38  9  1  0  0  0  0
 38 27  1  0  0  0  0
 39 15  1  0  0  0  0
 39 24  1  0  0  0  0
 40 16  1  0  0  0  0
 40 25  1  0  0  0  0
 41 26  1  0  0  0  0
 41 27  1  0  0  0  0
M  END
> <DATABASE_ID>
HMDB0035426

> <DATABASE_NAME>
hmdb

> <SMILES>
CC1OC(OC2C(O)C(O)C(CO)OC2C2=C(O)C=C(O)C3=C2OC(CC3=O)C2=CC=C(O)C=C2)C(O)C(O)C1O

> <INCHI_IDENTIFIER>
InChI=1S/C27H32O14/c1-9-19(33)21(35)23(37)27(38-9)41-26-22(36)20(34)16(8-28)40-25(26)18-13(31)6-12(30)17-14(32)7-15(39-24(17)18)10-2-4-11(29)5-3-10/h2-6,9,15-16,19-23,25-31,33-37H,7-8H2,1H3

> <INCHI_KEY>
LCTOQECBRZFOCD-UHFFFAOYSA-N

> <FORMULA>
C27H32O14

> <MOLECULAR_WEIGHT>
580.5346

> <EXACT_MASS>
580.179205732

> <JCHEM_ACCEPTOR_COUNT>
14

> <JCHEM_AVERAGE_POLARIZABILITY>
56.183253024149295

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
9

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
8-[4,5-dihydroxy-6-(hydroxymethyl)-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-4-one

> <ALOGPS_LOGP>
-0.45

> <JCHEM_LOGP>
-0.6461385336666662

> <ALOGPS_LOGS>
-1.92

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
5

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
9.443709093669302

> <JCHEM_PKA_STRONGEST_ACIDIC>
7.480839383503556

> <JCHEM_PKA_STRONGEST_BASIC>
-3.6121826114733837

> <JCHEM_POLAR_SURFACE_AREA>
236.05999999999995

> <JCHEM_REFRACTIVITY>
135.27769999999995

> <JCHEM_ROTATABLE_BOND_COUNT>
5

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
6.95e+00 g/l

> <JCHEM_TRADITIONAL_IUPAC>
8-[4,5-dihydroxy-6-(hydroxymethyl)-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-1-benzopyran-4-one

> <JCHEM_VEBER_RULE>
0

$$$$

HMDB0035426
     RDKit          3D
(S)-Naringenin 8-C-(2''-rhamnosylglucoside)
 73 77  0  0  0  0  0  0  0  0999 V2000
    3.2972    4.2541    1.0110 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4927    2.7419    1.1418 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2954    2.0710    1.1769 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1273    1.0715    0.2689 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8992    0.4475    0.5057 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0977   -0.8733    0.5596 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3118   -1.8327   -0.2226 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7501   -1.4856   -1.1293 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5997   -1.9732   -2.4524 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6439   -2.5677   -2.7804 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5895   -1.8777   -3.3774 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7871   -1.2878   -3.0180 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8578   -1.1384   -3.9028 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9793   -0.8075   -1.7398 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9528   -0.9134   -0.8227 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2302   -0.3943    0.4409 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5045   -0.1507    0.9741 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8773    1.2994    1.0109 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9847    2.3262    0.7065 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3957    3.6367    0.7140 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6988    3.9185    1.0238 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1665    5.2363    1.0391 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5939    2.9158    1.3304 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1848    1.5934    1.3256 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6208   -0.8000    0.1235 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2962   -0.3281   -1.2778 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9620    0.3494   -2.0180 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0137   -3.0041   -0.5053 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9374   -3.3950    0.4167 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7092   -4.9077    0.6218 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8137   -5.6220   -0.5476 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9469   -2.8015    1.7669 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5543   -3.7321    2.7250 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3031   -1.4574    1.9752 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0646   -1.5531    2.5671 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2746    1.6463   -1.1294 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9367    0.6969   -2.0976 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7363    2.0415   -1.2496 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4042    0.9474   -1.8575 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4161    2.2769    0.0521 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1800    1.2144    0.5138 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9934    4.7133    1.9783 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5932    4.4973    0.2055 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2895    4.6701    0.7528 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0083    2.6074    2.1117 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9496    0.3116    0.3144 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2246   -1.0610    0.1795 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3711   -2.3256    0.6971 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7519   -2.8699   -3.7379 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4500   -2.2476   -4.3628 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7698   -1.4375   -4.8587 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5374   -0.5408    2.0036 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9698    2.1078    0.4641 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7173    4.4496    0.4840 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5378    5.5282    0.1217 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6238    3.1214    1.5770 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9082    0.8602    1.5923 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4916   -1.8892    0.2221 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5888   -0.4563    0.4427 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9494   -3.3606   -0.0943 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4614   -5.2749    1.3778 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7279   -5.0745    1.0880 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3123   -6.4554   -0.3654 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0599   -2.6329    2.0121 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2958   -4.0401    3.2955 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9574   -0.7678    2.5613 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1520   -0.6504    2.9778 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6409    2.5293   -1.2342 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7396    0.3118   -2.5399 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8370    2.8660   -1.9618 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6149    0.2809   -1.1400 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1516    3.1228   -0.0974 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1352    1.3249    0.2706 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  2  0
  9 10  1  0
  9 11  1  0
 11 12  2  0
 12 13  1  0
 12 14  1  0
 14 15  2  0
 15 16  1  0
 16 17  1  0
 17 18  1  0
 18 19  2  0
 19 20  1  0
 20 21  2  0
 21 22  1  0
 21 23  1  0
 23 24  2  0
 17 25  1  0
 25 26  1  0
 26 27  2  0
  7 28  1  0
 28 29  1  0
 29 30  1  0
 30 31  1  0
 29 32  1  0
 32 33  1  0
 32 34  1  0
 34 35  1  0
  4 36  1  0
 36 37  1  0
 36 38  1  0
 38 39  1  0
 38 40  1  0
 40 41  1  0
 40  2  1  0
 34  6  1  0
 15  8  1  0
 24 18  1  0
 26 14  1  0
  1 42  1  0
  1 43  1  0
  1 44  1  0
  2 45  1  0
  4 46  1  0
  6 47  1  0
  7 48  1  0
 10 49  1  0
 11 50  1  0
 13 51  1  0
 17 52  1  0
 19 53  1  0
 20 54  1  0
 22 55  1  0
 23 56  1  0
 24 57  1  0
 25 58  1  0
 25 59  1  0
 29 60  1  0
 30 61  1  0
 30 62  1  0
 31 63  1  0
 32 64  1  0
 33 65  1  0
 34 66  1  0
 35 67  1  0
 36 68  1  0
 37 69  1  0
 38 70  1  0
 39 71  1  0
 40 72  1  0
 41 73  1  0
M  END

HEADER    PROTEIN                                 06-MAY-13   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   06-MAY-13         0                                  
HETATM    1  C   UNK     0      -1.334  -6.930   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       9.336  -2.310   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      10.669   0.000   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      10.669  -3.080   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      12.003  -0.770   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       2.667   1.540   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       8.002   1.540   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       6.668  -5.390   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0      -1.334  -5.390   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       9.336  -0.770   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      12.003  -2.310   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       4.001   2.310   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0       2.667   0.000   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       6.668   2.310   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       8.002   0.000   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       5.335  -4.620   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       5.335   1.540   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0       4.001  -0.770   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      -2.667  -4.620   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0       4.001  -5.390   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0      -2.667  -3.080   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0       2.667  -4.620   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0      -1.334  -2.310   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0       5.335   0.000   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0       4.001  -2.310   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0       2.667  -3.080   0.000  0.00  0.00           C+0
HETATM   27  C   UNK     0       0.000  -3.080   0.000  0.00  0.00           C+0
HETATM   28  O   UNK     0       6.668  -6.930   0.000  0.00  0.00           O+0
HETATM   29  O   UNK     0      13.337  -3.080   0.000  0.00  0.00           O+0
HETATM   30  O   UNK     0       4.001   3.850   0.000  0.00  0.00           O+0
HETATM   31  O   UNK     0       1.334  -0.770   0.000  0.00  0.00           O+0
HETATM   32  O   UNK     0       6.668   3.850   0.000  0.00  0.00           O+0
HETATM   33  O   UNK     0      -4.001  -5.390   0.000  0.00  0.00           O+0
HETATM   34  O   UNK     0       4.001  -6.930   0.000  0.00  0.00           O+0
HETATM   35  O   UNK     0      -4.001  -2.310   0.000  0.00  0.00           O+0
HETATM   36  O   UNK     0       1.334  -5.390   0.000  0.00  0.00           O+0
HETATM   37  O   UNK     0      -1.334  -0.770   0.000  0.00  0.00           O+0
HETATM   38  O   UNK     0       0.000  -4.620   0.000  0.00  0.00           O+0
HETATM   39  O   UNK     0       6.668  -0.770   0.000  0.00  0.00           O+0
HETATM   40  O   UNK     0       5.335  -3.080   0.000  0.00  0.00           O+0
HETATM   41  O   UNK     0       1.334  -2.310   0.000  0.00  0.00           O+0
CONECT    1    9                                                            
CONECT    2    4   10                                                       
CONECT    3    5   10                                                       
CONECT    4    2   11                                                       
CONECT    5    3   11                                                       
CONECT    6   12   13                                                       
CONECT    7   14   15                                                       
CONECT    8   16   28                                                       
CONECT    9    1   19   38                                                  
CONECT   10    2    3   15                                                  
CONECT   11    4    5   29                                                  
CONECT   12    6   17   30                                                  
CONECT   13    6   18   31                                                  
CONECT   14    7   17   32                                                  
CONECT   15    7   10   39                                                  
CONECT   16    8   20   40                                                  
CONECT   17   12   14   24                                                  
CONECT   18   13   24   25                                                  
CONECT   19    9   21   33                                                  
CONECT   20   16   22   34                                                  
CONECT   21   19   23   35                                                  
CONECT   22   20   26   36                                                  
CONECT   23   21   27   37                                                  
CONECT   24   17   18   39                                                  
CONECT   25   18   26   40                                                  
CONECT   26   22   25   41                                                  
CONECT   27   23   38   41                                                  
CONECT   28    8                                                            
CONECT   29   11                                                            
CONECT   30   12                                                            
CONECT   31   13                                                            
CONECT   32   14                                                            
CONECT   33   19                                                            
CONECT   34   20                                                            
CONECT   35   21                                                            
CONECT   36   22                                                            
CONECT   37   23                                                            
CONECT   38    9   27                                                       
CONECT   39   15   24                                                       
CONECT   40   16   25                                                       
CONECT   41   26   27                                                       
MASTER        0    0    0    0    0    0    0    0   41    0   90    0
END

COMPND    HMDB0035426
HETATM    1  C1  UNL     1       3.297   4.254   1.011  1.00  0.00           C  
HETATM    2  C2  UNL     1       3.493   2.742   1.142  1.00  0.00           C  
HETATM    3  O1  UNL     1       2.295   2.071   1.177  1.00  0.00           O  
HETATM    4  C3  UNL     1       2.127   1.072   0.269  1.00  0.00           C  
HETATM    5  O2  UNL     1       0.899   0.448   0.506  1.00  0.00           O  
HETATM    6  C4  UNL     1       1.098  -0.873   0.560  1.00  0.00           C  
HETATM    7  C5  UNL     1       0.312  -1.833  -0.223  1.00  0.00           C  
HETATM    8  C6  UNL     1      -0.750  -1.486  -1.129  1.00  0.00           C  
HETATM    9  C7  UNL     1      -0.600  -1.973  -2.452  1.00  0.00           C  
HETATM   10  O3  UNL     1       0.644  -2.568  -2.780  1.00  0.00           O  
HETATM   11  C8  UNL     1      -1.590  -1.878  -3.377  1.00  0.00           C  
HETATM   12  C9  UNL     1      -2.787  -1.288  -3.018  1.00  0.00           C  
HETATM   13  O4  UNL     1      -3.858  -1.138  -3.903  1.00  0.00           O  
HETATM   14  C10 UNL     1      -2.979  -0.808  -1.740  1.00  0.00           C  
HETATM   15  C11 UNL     1      -1.953  -0.913  -0.823  1.00  0.00           C  
HETATM   16  O5  UNL     1      -2.230  -0.394   0.441  1.00  0.00           O  
HETATM   17  C12 UNL     1      -3.504  -0.151   0.974  1.00  0.00           C  
HETATM   18  C13 UNL     1      -3.877   1.299   1.011  1.00  0.00           C  
HETATM   19  C14 UNL     1      -2.985   2.326   0.706  1.00  0.00           C  
HETATM   20  C15 UNL     1      -3.396   3.637   0.714  1.00  0.00           C  
HETATM   21  C16 UNL     1      -4.699   3.918   1.024  1.00  0.00           C  
HETATM   22  O6  UNL     1      -5.166   5.236   1.039  1.00  0.00           O  
HETATM   23  C17 UNL     1      -5.594   2.916   1.330  1.00  0.00           C  
HETATM   24  C18 UNL     1      -5.185   1.593   1.326  1.00  0.00           C  
HETATM   25  C19 UNL     1      -4.621  -0.800   0.123  1.00  0.00           C  
HETATM   26  C20 UNL     1      -4.296  -0.328  -1.278  1.00  0.00           C  
HETATM   27  O7  UNL     1      -4.962   0.349  -2.018  1.00  0.00           O  
HETATM   28  O8  UNL     1       1.014  -3.004  -0.505  1.00  0.00           O  
HETATM   29  C21 UNL     1       1.937  -3.395   0.417  1.00  0.00           C  
HETATM   30  C22 UNL     1       1.709  -4.908   0.622  1.00  0.00           C  
HETATM   31  O9  UNL     1       1.814  -5.622  -0.548  1.00  0.00           O  
HETATM   32  C23 UNL     1       1.947  -2.802   1.767  1.00  0.00           C  
HETATM   33  O10 UNL     1       1.554  -3.732   2.725  1.00  0.00           O  
HETATM   34  C24 UNL     1       1.303  -1.457   1.975  1.00  0.00           C  
HETATM   35  O11 UNL     1       0.065  -1.553   2.567  1.00  0.00           O  
HETATM   36  C25 UNL     1       2.275   1.646  -1.129  1.00  0.00           C  
HETATM   37  O12 UNL     1       1.937   0.697  -2.098  1.00  0.00           O  
HETATM   38  C26 UNL     1       3.736   2.041  -1.250  1.00  0.00           C  
HETATM   39  O13 UNL     1       4.404   0.947  -1.857  1.00  0.00           O  
HETATM   40  C27 UNL     1       4.416   2.277   0.052  1.00  0.00           C  
HETATM   41  O14 UNL     1       5.180   1.214   0.514  1.00  0.00           O  
HETATM   42  H1  UNL     1       2.993   4.713   1.978  1.00  0.00           H  
HETATM   43  H2  UNL     1       2.593   4.497   0.206  1.00  0.00           H  
HETATM   44  H3  UNL     1       4.289   4.670   0.753  1.00  0.00           H  
HETATM   45  H4  UNL     1       4.008   2.607   2.112  1.00  0.00           H  
HETATM   46  H5  UNL     1       2.950   0.312   0.314  1.00  0.00           H  
HETATM   47  H6  UNL     1       2.225  -1.061   0.180  1.00  0.00           H  
HETATM   48  H7  UNL     1      -0.371  -2.326   0.697  1.00  0.00           H  
HETATM   49  H8  UNL     1       0.752  -2.870  -3.738  1.00  0.00           H  
HETATM   50  H9  UNL     1      -1.450  -2.248  -4.363  1.00  0.00           H  
HETATM   51  H10 UNL     1      -3.770  -1.437  -4.859  1.00  0.00           H  
HETATM   52  H11 UNL     1      -3.537  -0.541   2.004  1.00  0.00           H  
HETATM   53  H12 UNL     1      -1.970   2.108   0.464  1.00  0.00           H  
HETATM   54  H13 UNL     1      -2.717   4.450   0.484  1.00  0.00           H  
HETATM   55  H14 UNL     1      -5.538   5.528   0.122  1.00  0.00           H  
HETATM   56  H15 UNL     1      -6.624   3.121   1.577  1.00  0.00           H  
HETATM   57  H16 UNL     1      -5.908   0.860   1.592  1.00  0.00           H  
HETATM   58  H17 UNL     1      -4.492  -1.889   0.222  1.00  0.00           H  
HETATM   59  H18 UNL     1      -5.589  -0.456   0.443  1.00  0.00           H  
HETATM   60  H19 UNL     1       2.949  -3.361  -0.094  1.00  0.00           H  
HETATM   61  H20 UNL     1       2.461  -5.275   1.378  1.00  0.00           H  
HETATM   62  H21 UNL     1       0.728  -5.074   1.088  1.00  0.00           H  
HETATM   63  H22 UNL     1       2.312  -6.455  -0.365  1.00  0.00           H  
HETATM   64  H23 UNL     1       3.060  -2.633   2.012  1.00  0.00           H  
HETATM   65  H24 UNL     1       2.296  -4.040   3.296  1.00  0.00           H  
HETATM   66  H25 UNL     1       1.957  -0.768   2.561  1.00  0.00           H  
HETATM   67  H26 UNL     1      -0.152  -0.650   2.978  1.00  0.00           H  
HETATM   68  H27 UNL     1       1.641   2.529  -1.234  1.00  0.00           H  
HETATM   69  H28 UNL     1       2.740   0.312  -2.540  1.00  0.00           H  
HETATM   70  H29 UNL     1       3.837   2.866  -1.962  1.00  0.00           H  
HETATM   71  H30 UNL     1       4.615   0.281  -1.140  1.00  0.00           H  
HETATM   72  H31 UNL     1       5.152   3.123  -0.097  1.00  0.00           H  
HETATM   73  H32 UNL     1       6.135   1.325   0.271  1.00  0.00           H  
CONECT    1    2   42   43   44
CONECT    2    3   40   45
CONECT    3    4
CONECT    4    5   36   46
CONECT    5    6
CONECT    6    7   34   47
CONECT    7    8   28   48
CONECT    8    9    9   15
CONECT    9   10   11
CONECT   10   49
CONECT   11   12   12   50
CONECT   12   13   14
CONECT   13   51
CONECT   14   15   15   26
CONECT   15   16
CONECT   16   17
CONECT   17   18   25   52
CONECT   18   19   19   24
CONECT   19   20   53
CONECT   20   21   21   54
CONECT   21   22   23
CONECT   22   55
CONECT   23   24   24   56
CONECT   24   57
CONECT   25   26   58   59
CONECT   26   27   27
CONECT   28   29
CONECT   29   30   32   60
CONECT   30   31   61   62
CONECT   31   63
CONECT   32   33   34   64
CONECT   33   65
CONECT   34   35   66
CONECT   35   67
CONECT   36   37   38   68
CONECT   37   69
CONECT   38   39   40   70
CONECT   39   71
CONECT   40   41   72
CONECT   41   73
END

HMDB0035426
     RDKit          3D
(S)-Naringenin 8-C-(2''-rhamnosylglucoside)
 73 77  0  0  0  0  0  0  0  0999 V2000
    3.2972    4.2541    1.0110 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4927    2.7419    1.1418 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2954    2.0710    1.1769 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1273    1.0715    0.2689 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8992    0.4475    0.5057 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0977   -0.8733    0.5596 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3118   -1.8327   -0.2226 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7501   -1.4856   -1.1293 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5997   -1.9732   -2.4524 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6439   -2.5677   -2.7804 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5895   -1.8777   -3.3774 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7871   -1.2878   -3.0180 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8578   -1.1384   -3.9028 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9793   -0.8075   -1.7398 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9528   -0.9134   -0.8227 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2302   -0.3943    0.4409 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5045   -0.1507    0.9741 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8773    1.2994    1.0109 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9847    2.3262    0.7065 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3957    3.6367    0.7140 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6988    3.9185    1.0238 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1665    5.2363    1.0391 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5939    2.9158    1.3304 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1848    1.5934    1.3256 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6208   -0.8000    0.1235 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2962   -0.3281   -1.2778 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9620    0.3494   -2.0180 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0137   -3.0041   -0.5053 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9374   -3.3950    0.4167 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7092   -4.9077    0.6218 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8137   -5.6220   -0.5476 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9469   -2.8015    1.7669 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5543   -3.7321    2.7250 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3031   -1.4574    1.9752 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0646   -1.5531    2.5671 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2746    1.6463   -1.1294 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9367    0.6969   -2.0976 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7363    2.0415   -1.2496 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4042    0.9474   -1.8575 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4161    2.2769    0.0521 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1800    1.2144    0.5138 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9934    4.7133    1.9783 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5932    4.4973    0.2055 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2895    4.6701    0.7528 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0083    2.6074    2.1117 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9496    0.3116    0.3144 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2246   -1.0610    0.1795 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3711   -2.3256    0.6971 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7519   -2.8699   -3.7379 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4500   -2.2476   -4.3628 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7698   -1.4375   -4.8587 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5374   -0.5408    2.0036 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9698    2.1078    0.4641 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7173    4.4496    0.4840 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5378    5.5282    0.1217 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6238    3.1214    1.5770 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9082    0.8602    1.5923 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4916   -1.8892    0.2221 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5888   -0.4563    0.4427 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9494   -3.3606   -0.0943 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4614   -5.2749    1.3778 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7279   -5.0745    1.0880 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3123   -6.4554   -0.3654 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0599   -2.6329    2.0121 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2958   -4.0401    3.2955 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9574   -0.7678    2.5613 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1520   -0.6504    2.9778 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6409    2.5293   -1.2342 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7396    0.3118   -2.5399 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8370    2.8660   -1.9618 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6149    0.2809   -1.1400 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1516    3.1228   -0.0974 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1352    1.3249    0.2706 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  2  0
  9 10  1  0
  9 11  1  0
 11 12  2  0
 12 13  1  0
 12 14  1  0
 14 15  2  0
 15 16  1  0
 16 17  1  0
 17 18  1  0
 18 19  2  0
 19 20  1  0
 20 21  2  0
 21 22  1  0
 21 23  1  0
 23 24  2  0
 17 25  1  0
 25 26  1  0
 26 27  2  0
  7 28  1  0
 28 29  1  0
 29 30  1  0
 30 31  1  0
 29 32  1  0
 32 33  1  0
 32 34  1  0
 34 35  1  0
  4 36  1  0
 36 37  1  0
 36 38  1  0
 38 39  1  0
 38 40  1  0
 40 41  1  0
 40  2  1  0
 34  6  1  0
 15  8  1  0
 24 18  1  0
 26 14  1  0
  1 42  1  0
  1 43  1  0
  1 44  1  0
  2 45  1  0
  4 46  1  0
  6 47  1  0
  7 48  1  0
 10 49  1  0
 11 50  1  0
 13 51  1  0
 17 52  1  0
 19 53  1  0
 20 54  1  0
 22 55  1  0
 23 56  1  0
 24 57  1  0
 25 58  1  0
 25 59  1  0
 29 60  1  0
 30 61  1  0
 30 62  1  0
 31 63  1  0
 32 64  1  0
 33 65  1  0
 34 66  1  0
 35 67  1  0
 36 68  1  0
 37 69  1  0
 38 70  1  0
 39 71  1  0
 40 72  1  0
 41 73  1  0
M  END

View in JSmol View NMR Assignments View Stereo Labels

Synonyms

Not Available

Chemical Formula

C₂₇H₃₂O₁₄

Average Molecular Weight

580.5346

Monoisotopic Molecular Weight

580.179205732

IUPAC Name

8-[4,5-dihydroxy-6-(hydroxymethyl)-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-4-one

Traditional Name

8-[4,5-dihydroxy-6-(hydroxymethyl)-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-1-benzopyran-4-one

CAS Registry Number

Not Available

SMILES

CC1OC(OC2C(O)C(O)C(CO)OC2C2=C(O)C=C(O)C3=C2OC(CC3=O)C2=CC=C(O)C=C2)C(O)C(O)C1O

InChI Identifier

InChI=1S/C27H32O14/c1-9-19(33)21(35)23(37)27(38-9)41-26-22(36)20(34)16(8-28)40-25(26)18-13(31)6-12(30)17-14(32)7-15(39-24(17)18)10-2-4-11(29)5-3-10/h2-6,9,15-16,19-23,25-31,33-37H,7-8H2,1H3

InChI Key

LCTOQECBRZFOCD-UHFFFAOYSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as flavonoid 8-c-glycosides. Flavonoid 8-C-glycosides are compounds containing a carbohydrate moiety which is C-glycosidically linked to 8-position of a 2-phenylchromen-4-one flavonoid backbone.

Kingdom

Organic compounds

Super Class

Phenylpropanoids and polyketides

Class

Flavonoids

Sub Class

Flavonoid glycosides

Direct Parent

Flavonoid 8-C-glycosides

Alternative Parents

Substituents

Flavonoid-8-c-glycoside
4'-hydroxyflavonoid
5-hydroxyflavonoid
7-hydroxyflavonoid
Flavanone
Hydroxyflavonoid
Flavan
Phenolic glycoside
C-glycosyl compound
Chromone
Disaccharide
Glycosyl compound
O-glycosyl compound
Chromane
Benzopyran
1-benzopyran
Aryl alkyl ketone
Aryl ketone
Phenol
1-hydroxy-2-unsubstituted benzenoid
Alkyl aryl ether
Monocyclic benzene moiety
Oxane
Benzenoid
Vinylogous acid
Secondary alcohol
Ketone
Dialkyl ether
Ether
Oxacycle
Acetal
Organoheterocyclic compound
Polyol
Primary alcohol
Organic oxygen compound
Organic oxide
Hydrocarbon derivative
Alcohol
Organooxygen compound
Aromatic heteropolycyclic compound

Molecular Framework

Aromatic heteropolycyclic compounds

External Descriptors

Not Available

Ontology

Physiological effect

Not Available

Disposition

Biological location

Cellular substructure

Extracellular (HMDB: HMDB0035426)
Cytoplasm (HMDB: HMDB0035426)

Fruits (FooDB: FOOD00871)

Process

Not Available

Role

Not Available

Physical Properties

State

Not Available

Experimental Molecular Properties

Property	Value	Reference
Melting Point	Not Available	Not Available
Boiling Point	Not Available	Not Available
Water Solubility	Not Available	Not Available
LogP	Not Available	Not Available

Experimental Chromatographic Properties

Not Available

Predicted Molecular Properties

Property	Value	Source
Water Solubility	6.95 g/L	ALOGPS
logP	-0.45	ALOGPS
logP	-0.65	ChemAxon
logS	-1.9	ALOGPS
pKa (Strongest Acidic)	7.48	ChemAxon
pKa (Strongest Basic)	-3.6	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	14	ChemAxon
Hydrogen Donor Count	9	ChemAxon
Polar Surface Area	236.06 Å²	ChemAxon
Rotatable Bond Count	5	ChemAxon
Refractivity	135.28 m³·mol⁻¹	ChemAxon
Polarizability	56.18 Å³	ChemAxon
Number of Rings	5	ChemAxon
Bioavailability	No	ChemAxon
Rule of Five	No	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	No	ChemAxon

Predicted Chromatographic Properties

Predicted Collision Cross Sections

Predictor	Adduct Type	CCS Value (Å²)	Reference
DarkChem	[M+H]+	229.284	31661259
DarkChem	[M-H]-	220.986	31661259
DeepCCS	[M+H]+	224.416	30932474
DeepCCS	[M-H]-	222.02	30932474
DeepCCS	[M-2H]-	255.007	30932474
DeepCCS	[M+Na]+	230.329	30932474
AllCCS	[M+H]+	233.0	32859911
AllCCS	[M+H-H2O]+	231.5	32859911
AllCCS	[M+NH4]+	234.3	32859911
AllCCS	[M+Na]+	234.7	32859911
AllCCS	[M-H]-	231.1	32859911
AllCCS	[M+Na-2H]-	233.4	32859911
AllCCS	[M+HCOO]-	236.1	32859911

Predicted Kovats Retention Indices

Underivatized

Metabolite	SMILES	Kovats RI Value	Column Type	Reference
(S)-Naringenin 8-C-(2''-rhamnosylglucoside)	CC1OC(OC2C(O)C(O)C(CO)OC2C2=C(O)C=C(O)C3=C2OC(CC3=O)C2=CC=C(O)C=C2)C(O)C(O)C1O	5175.4	Standard polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside)	CC1OC(OC2C(O)C(O)C(CO)OC2C2=C(O)C=C(O)C3=C2OC(CC3=O)C2=CC=C(O)C=C2)C(O)C(O)C1O	4831.6	Standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside)	CC1OC(OC2C(O)C(O)C(CO)OC2C2=C(O)C=C(O)C3=C2OC(CC3=O)C2=CC=C(O)C=C2)C(O)C(O)C1O	5275.3	Semi standard non polar	33892256

Derivatized

Derivative Name / Structure	SMILES	Kovats RI Value	Column Type	Reference
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),1TMS,isomer #1	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O	5188.1	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),1TMS,isomer #2	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O	5171.7	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),1TMS,isomer #3	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O)C(O)C(O)C1O	5165.7	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),1TMS,isomer #4	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O)C(O)C(O)C1O	5209.6	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),1TMS,isomer #5	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O)C(O)C(O)C1O	5202.3	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),1TMS,isomer #6	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O)C(O)C(O)C1O	5246.2	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),1TMS,isomer #7	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O	5177.5	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),1TMS,isomer #8	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O	5173.0	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),1TMS,isomer #9	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C	5192.8	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TMS,isomer #1	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O	5141.3	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TMS,isomer #10	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O	5172.7	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TMS,isomer #11	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O	5170.0	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TMS,isomer #12	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O	5123.7	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TMS,isomer #13	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O	5112.3	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TMS,isomer #14	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O	5091.2	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TMS,isomer #15	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C	5128.0	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TMS,isomer #16	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O)C(O)C(O)C1O	5138.9	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TMS,isomer #17	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O)C(O)C(O)C1O	5163.9	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TMS,isomer #18	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O)C(O)C(O)C1O	5181.8	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TMS,isomer #19	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O	5114.0	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TMS,isomer #2	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O	5181.9	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TMS,isomer #20	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O	5095.6	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TMS,isomer #21	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C	5131.6	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TMS,isomer #22	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O)C(O)C(O)C1O	5151.3	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TMS,isomer #23	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O)C(O)C(O)C1O	5206.4	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TMS,isomer #24	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O	5137.7	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TMS,isomer #25	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O	5112.3	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TMS,isomer #26	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C	5153.8	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TMS,isomer #27	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O)C(O)C(O)C1O	5216.8	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TMS,isomer #28	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O	5175.0	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TMS,isomer #29	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O	5155.3	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TMS,isomer #3	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O	5182.2	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TMS,isomer #30	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C	5186.8	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TMS,isomer #31	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O	5168.2	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TMS,isomer #32	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O	5151.3	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TMS,isomer #33	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C	5188.1	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TMS,isomer #34	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	5129.2	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TMS,isomer #35	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	5128.7	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TMS,isomer #36	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	5136.1	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TMS,isomer #4	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O	5121.6	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TMS,isomer #5	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O	5162.8	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TMS,isomer #6	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	5131.9	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TMS,isomer #7	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	5101.6	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TMS,isomer #8	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	5138.4	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TMS,isomer #9	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O	5128.8	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #1	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O	5006.4	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #10	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O	5072.3	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #11	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	5041.1	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #12	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	5000.8	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #13	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	5054.4	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #14	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O	5056.6	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #15	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O	5106.3	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #16	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	5070.3	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #17	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	5025.6	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #18	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	5081.9	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #19	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O	5009.3	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #2	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O	5083.4	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #20	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	4954.6	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #21	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	4923.2	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #22	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	4980.0	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #23	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	5013.0	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #24	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	4980.7	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #25	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	5025.1	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #26	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4978.8	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #27	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4999.3	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #28	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4987.1	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #29	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O	5010.9	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #3	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O	4982.0	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #30	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O	5079.1	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #31	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O	4993.2	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #32	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O	4987.5	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #33	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O	4950.6	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #34	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C	5007.5	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #35	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O	5123.0	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #36	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O	5033.0	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #37	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O	5042.7	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #38	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O	5004.7	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #39	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C	5059.4	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #4	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O	5025.3	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #40	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O	5064.3	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #41	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O	5061.1	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #42	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O	5022.1	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #43	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C	5078.1	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #44	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O	4965.9	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #45	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O	4932.1	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #46	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C	4990.3	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #47	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4976.8	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #48	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4997.9	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #49	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4989.4	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #5	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	4989.1	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #50	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O)C(O)C(O)C1O	5007.7	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #51	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O)C(O)C(O)C1O	5084.1	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #52	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O	4978.7	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #53	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O	4942.3	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #54	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C	5006.2	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #55	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O)C(O)C(O)C1O	5117.3	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #56	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O	5020.0	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #57	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O	4990.6	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #58	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C	5044.3	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #59	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O	5055.4	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #6	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	4950.2	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #60	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O	5019.6	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #61	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C	5075.6	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #62	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4955.3	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #63	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4979.3	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #64	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4975.9	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #65	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O)C(O)C(O)C1O	5113.7	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #66	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O	5013.7	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #67	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O	4973.7	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #68	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C	5041.7	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #69	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O	5086.2	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #7	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	5006.8	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #70	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O	5042.5	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #71	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C	5113.0	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #72	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	5003.6	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #73	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	5022.8	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #74	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	5016.4	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #75	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O	5124.5	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #76	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O	5088.1	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #77	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C	5145.9	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #78	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	5041.1	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #79	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	5061.7	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #8	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O	5124.6	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #80	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	5054.3	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #81	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	5077.4	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #82	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	5088.4	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #83	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	5080.9	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #84	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	5018.5	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),3TMS,isomer #9	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O	5022.1	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #1	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O	4902.4	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #10	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	4831.6	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #100	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4814.5	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #101	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4813.4	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #102	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O	4928.7	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #103	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O	4882.7	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #104	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C	4966.9	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #105	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4825.0	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #106	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4855.7	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #107	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4853.2	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #108	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4867.4	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #109	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4902.3	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #11	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	4918.5	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #110	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4888.9	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #111	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4822.1	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #112	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O	4901.6	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #113	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O	4850.5	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #114	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C	4948.3	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #115	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4810.2	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #116	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4837.5	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #117	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4831.0	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #118	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4898.9	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #119	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4925.4	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #12	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O	4862.5	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #120	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4908.4	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #121	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4852.2	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #122	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4930.1	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #123	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4958.1	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #124	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4945.4	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #125	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4888.2	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #126	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4924.8	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #13	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	4795.0	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #14	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	4751.5	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #15	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	4836.2	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #16	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	4827.8	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #17	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	4788.2	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #18	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	4861.7	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #19	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4791.4	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #2	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O	4828.7	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #20	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4813.4	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #21	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4804.3	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #22	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O	4935.8	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #23	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O	4967.4	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #24	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	4921.0	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #25	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	4878.6	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #26	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	4958.5	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #27	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O	4900.1	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #28	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	4836.8	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #29	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	4789.1	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #3	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O	4853.2	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #30	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	4868.9	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #31	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	4875.0	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #32	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	4827.1	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #33	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	4901.3	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #34	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4829.7	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #35	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4851.4	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #36	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4840.5	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #37	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O	4928.6	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #38	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	4876.0	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #39	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	4845.8	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #4	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	4786.9	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #40	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	4917.3	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #41	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	4913.1	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #42	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	4874.9	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #43	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	4940.9	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #44	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4884.2	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #45	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4905.0	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #46	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4889.3	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #47	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	4835.8	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #48	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	4793.9	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #49	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	4864.9	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #5	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	4738.9	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #50	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4770.6	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #51	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4801.7	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #52	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4797.8	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #53	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4813.8	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #54	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4839.0	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #55	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4824.7	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #56	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4836.0	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #57	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O	4907.5	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #58	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O	4839.3	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #59	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O	4794.3	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #6	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	4836.1	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #60	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O	4748.1	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #61	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C	4849.5	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #62	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O	4911.5	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #63	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O	4879.2	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #64	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O	4828.2	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #65	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C	4918.4	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #66	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O	4799.8	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #67	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O	4757.8	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #68	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C	4844.2	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #69	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4787.8	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #7	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O	4903.8	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #70	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4810.2	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #71	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4805.9	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #72	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O	4947.3	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #73	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O	4920.8	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #74	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O	4880.4	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #75	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C	4965.7	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #76	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O	4844.7	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #77	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O	4799.5	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #78	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C	4881.3	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #79	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4827.0	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #8	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O	4933.6	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #80	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4853.5	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #81	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4846.4	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #82	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O	4880.8	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #83	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O	4852.1	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #84	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C	4924.8	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #85	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4878.8	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #86	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4902.7	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #87	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4891.8	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #88	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4771.7	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #89	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4804.6	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #9	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	4882.9	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #90	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4800.8	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #91	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4832.0	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #92	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O)C(O)C(O)C1O	4925.7	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #93	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O	4804.8	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #94	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O	4753.5	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #95	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C	4853.9	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #96	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O	4889.7	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #97	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O	4839.8	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #98	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C	4934.4	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),4TMS,isomer #99	CC1OC(OC2C(C3=C(O[Si](C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4784.1	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),1TBDMS,isomer #1	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O	5443.1	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),1TBDMS,isomer #2	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C(C)(C)C)C2O)C(O)C(O)C1O	5433.9	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),1TBDMS,isomer #3	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C(C)(C)C)C(O)C2O)C(O)C(O)C1O	5391.9	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),1TBDMS,isomer #4	CC1OC(OC2C(C3=C(O[Si](C)(C)C(C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O)C(O)C(O)C1O	5433.1	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),1TBDMS,isomer #5	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C(C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O)C(O)C(O)C1O	5425.7	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),1TBDMS,isomer #6	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C(C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O)C(O)C(O)C1O	5465.3	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),1TBDMS,isomer #7	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O	5436.7	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),1TBDMS,isomer #8	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O	5433.2	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),1TBDMS,isomer #9	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C(C)(C)C	5456.2	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TBDMS,isomer #1	CC1OC(OC2C(C3=C(O[Si](C)(C)C(C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O	5567.1	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TBDMS,isomer #10	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C(C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C(C)(C)C)C2O)C(O)C(O)C1O	5578.4	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TBDMS,isomer #11	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C(C)(C)C)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C(C)(C)C)C2O)C(O)C(O)C1O	5615.0	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TBDMS,isomer #12	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C2O)C(O)C(O)C1O	5541.7	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TBDMS,isomer #13	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C(C)(C)C)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O	5537.1	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TBDMS,isomer #14	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C(C)(C)C)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O	5528.3	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TBDMS,isomer #15	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C(C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C(C)(C)C	5577.1	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TBDMS,isomer #16	CC1OC(OC2C(C3=C(O[Si](C)(C)C(C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C(C)(C)C)C(O)C2O)C(O)C(O)C1O	5542.7	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TBDMS,isomer #17	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C(C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C(C)(C)C)C(O)C2O)C(O)C(O)C1O	5548.7	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TBDMS,isomer #18	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C(C)(C)C)C=C3)CC4=O)OC(CO[Si](C)(C)C(C)(C)C)C(O)C2O)C(O)C(O)C1O	5592.5	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TBDMS,isomer #19	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C(C)(C)C)C(O)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O	5520.1	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TBDMS,isomer #2	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C(C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O	5575.4	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TBDMS,isomer #20	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C(C)(C)C)C(O)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O	5505.4	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TBDMS,isomer #21	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C(C)(C)C)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C(C)(C)C	5555.3	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TBDMS,isomer #22	CC1OC(OC2C(C3=C(O[Si](C)(C)C(C)(C)C)C=C(O[Si](C)(C)C(C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O)C(O)C(O)C1O	5548.6	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TBDMS,isomer #23	CC1OC(OC2C(C3=C(O[Si](C)(C)C(C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C(C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O)C(O)C(O)C1O	5620.0	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TBDMS,isomer #24	CC1OC(OC2C(C3=C(O[Si](C)(C)C(C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O	5555.7	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TBDMS,isomer #25	CC1OC(OC2C(C3=C(O[Si](C)(C)C(C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O	5552.9	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TBDMS,isomer #26	CC1OC(OC2C(C3=C(O[Si](C)(C)C(C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C(C)(C)C	5591.4	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TBDMS,isomer #27	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C(C)(C)C)C4=C3OC(C3=CC=C(O[Si](C)(C)C(C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O)C(O)C(O)C1O	5617.8	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TBDMS,isomer #28	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C(C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O	5563.3	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TBDMS,isomer #29	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C(C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O	5557.4	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TBDMS,isomer #3	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C(C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O	5620.7	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TBDMS,isomer #30	CC1OC(OC2C(C3=C(O)C=C(O[Si](C)(C)C(C)(C)C)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C(C)(C)C	5598.3	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TBDMS,isomer #31	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C(C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O	5590.6	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TBDMS,isomer #32	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C(C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O	5601.0	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TBDMS,isomer #33	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O[Si](C)(C)C(C)(C)C)C=C3)CC4=O)OC(CO)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C(C)(C)C	5628.6	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TBDMS,isomer #34	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O	5552.9	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TBDMS,isomer #35	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O[Si](C)(C)C(C)(C)C	5568.5	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TBDMS,isomer #36	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C	5583.6	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TBDMS,isomer #4	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO[Si](C)(C)C(C)(C)C)C(O)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O	5541.0	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TBDMS,isomer #5	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O	5579.3	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TBDMS,isomer #6	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)C1O	5540.6	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TBDMS,isomer #7	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C1O	5532.3	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TBDMS,isomer #8	CC1OC(OC2C(C3=C(O)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O[Si](C)(C)C(C)(C)C	5576.5	Semi standard non polar	33892256
(S)-Naringenin 8-C-(2''-rhamnosylglucoside),2TBDMS,isomer #9	CC1OC(OC2C(C3=C(O[Si](C)(C)C(C)(C)C)C=C(O)C4=C3OC(C3=CC=C(O)C=C3)CC4=O)OC(CO)C(O[Si](C)(C)C(C)(C)C)C2O)C(O)C(O)C1O	5563.6	Semi standard non polar	33892256

Spectra

GC-MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Predicted GC-MS	Predicted GC-MS Spectrum - (S)-Naringenin 8-C-(2''-rhamnosylglucoside) GC-MS (Non-derivatized) - 70eV, Positive	splash10-022a-6533590000-c9ee86a734159864b64b	2017-09-01	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - (S)-Naringenin 8-C-(2''-rhamnosylglucoside) GC-MS (1 TMS) - 70eV, Positive	splash10-022i-9415365000-02e5c758c5f681e277e6	2017-10-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - (S)-Naringenin 8-C-(2''-rhamnosylglucoside) GC-MS ("(S)-Naringenin 8-C-(2''-rhamnosylglucoside),1TMS,#1" TMS) - 70eV, Positive	Not Available	2021-10-14	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - (S)-Naringenin 8-C-(2''-rhamnosylglucoside) GC-MS (TMS_1_2) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - (S)-Naringenin 8-C-(2''-rhamnosylglucoside) GC-MS (TMS_1_3) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - (S)-Naringenin 8-C-(2''-rhamnosylglucoside) GC-MS (TMS_1_4) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - (S)-Naringenin 8-C-(2''-rhamnosylglucoside) GC-MS (TMS_1_5) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - (S)-Naringenin 8-C-(2''-rhamnosylglucoside) GC-MS (TMS_1_6) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - (S)-Naringenin 8-C-(2''-rhamnosylglucoside) GC-MS (TMS_1_7) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - (S)-Naringenin 8-C-(2''-rhamnosylglucoside) GC-MS (TMS_1_8) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - (S)-Naringenin 8-C-(2''-rhamnosylglucoside) GC-MS (TMS_1_9) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - (S)-Naringenin 8-C-(2''-rhamnosylglucoside) GC-MS (TMS_2_1) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - (S)-Naringenin 8-C-(2''-rhamnosylglucoside) GC-MS (TMS_2_2) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - (S)-Naringenin 8-C-(2''-rhamnosylglucoside) GC-MS (TMS_2_3) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - (S)-Naringenin 8-C-(2''-rhamnosylglucoside) GC-MS (TMS_2_4) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - (S)-Naringenin 8-C-(2''-rhamnosylglucoside) GC-MS (TMS_2_5) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - (S)-Naringenin 8-C-(2''-rhamnosylglucoside) GC-MS (TMS_2_6) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - (S)-Naringenin 8-C-(2''-rhamnosylglucoside) GC-MS (TMS_2_7) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - (S)-Naringenin 8-C-(2''-rhamnosylglucoside) GC-MS (TMS_2_8) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - (S)-Naringenin 8-C-(2''-rhamnosylglucoside) GC-MS (TMS_2_9) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - (S)-Naringenin 8-C-(2''-rhamnosylglucoside) GC-MS (TMS_2_10) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - (S)-Naringenin 8-C-(2''-rhamnosylglucoside) GC-MS (TMS_2_11) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - (S)-Naringenin 8-C-(2''-rhamnosylglucoside) GC-MS (TMS_2_12) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - (S)-Naringenin 8-C-(2''-rhamnosylglucoside) GC-MS (TMS_2_13) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - (S)-Naringenin 8-C-(2''-rhamnosylglucoside) GC-MS (TMS_2_14) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum

MS/MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - (S)-Naringenin 8-C-(2''-rhamnosylglucoside) 10V, Positive-QTOF	splash10-02a9-0200970000-f85144c58c5a21810906	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - (S)-Naringenin 8-C-(2''-rhamnosylglucoside) 20V, Positive-QTOF	splash10-014r-0311900000-9cd2ebb1b41d04821069	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - (S)-Naringenin 8-C-(2''-rhamnosylglucoside) 40V, Positive-QTOF	splash10-02ta-0859400000-9804c8a01af149cb7c82	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - (S)-Naringenin 8-C-(2''-rhamnosylglucoside) 10V, Negative-QTOF	splash10-004i-2210790000-48dd9eaea4af97160037	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - (S)-Naringenin 8-C-(2''-rhamnosylglucoside) 20V, Negative-QTOF	splash10-045c-5623930000-5c3d91ba1741d88a8208	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - (S)-Naringenin 8-C-(2''-rhamnosylglucoside) 40V, Negative-QTOF	splash10-03di-6914300000-ad3f3e55ae6c13d51aea	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - (S)-Naringenin 8-C-(2''-rhamnosylglucoside) 10V, Negative-QTOF	splash10-004i-0000090000-af121074cc6facc4ad7d	2021-09-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - (S)-Naringenin 8-C-(2''-rhamnosylglucoside) 20V, Negative-QTOF	splash10-056r-0000980000-9d2277c7f850b517c293	2021-09-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - (S)-Naringenin 8-C-(2''-rhamnosylglucoside) 40V, Negative-QTOF	splash10-014i-0900400000-c16a1aca133fd1608df1	2021-09-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - (S)-Naringenin 8-C-(2''-rhamnosylglucoside) 10V, Positive-QTOF	splash10-001i-0000090000-3d42de4ebfa0c2abf923	2021-09-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - (S)-Naringenin 8-C-(2''-rhamnosylglucoside) 20V, Positive-QTOF	splash10-03ea-0400960000-78f0ec8e3e6b9dd5bf92	2021-09-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - (S)-Naringenin 8-C-(2''-rhamnosylglucoside) 40V, Positive-QTOF	splash10-03di-0300900000-30c1909ab21c7b8de4d0	2021-09-24	Wishart Lab	View Spectrum

NMR Spectra

Spectrum Type	Description	Deposition Date	Source	View
Predicted 1D NMR	¹³C NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum

Biological Properties

Cellular Locations

Cytoplasm
Extracellular

Biospecimen Locations

Not Available

Tissue Locations

Not Available

Pathways

Not Available

Name	SMPDB/PathBank	KEGG

Normal Concentrations

Not Available

Abnormal Concentrations

Not Available

Associated Disorders and Diseases

Disease References

None

Associated OMIM IDs

None

External Links

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FooDB ID

FDB014106

KNApSAcK ID

Not Available

Chemspider ID

Not Available

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

131751745

PDB ID

Not Available

ChEBI ID

Not Available

Food Biomarker Ontology

Not Available

VMH ID

Not Available

MarkerDB ID

Not Available

Good Scents ID

Not Available

References

Synthesis Reference

Not Available

Material Safety Data Sheet (MSDS)

Not Available

General References

(). Yannai, Shmuel. (2004) Dictionary of food compounds with CD-ROM: Additives, flavors, and ingredients. Boca Raton: Chapman & Hall/CRC.. .

Enzymes

Enzyme Details

1. Sulfotransferase family cytosolic 2B member 1

General function:: Involved in sulfotransferase activity
Specific function:: Sulfotransferase that utilizes 3'-phospho-5'-adenylyl sulfate (PAPS) as sulfonate donor to catalyze the sulfate conjugation of many hormones, neurotransmitters, drugs and xenobiotic compounds. Sulfonation increases the water solubility of most compounds, and therefore their renal excretion, but it can also result in bioactivation to form active metabolites. Sulfates hydroxysteroids like DHEA. Isoform 1 preferentially sulfonates cholesterol, and isoform 2 avidly sulfonates pregnenolone but not cholesterol.
Gene Name:: SULT2B1
Uniprot ID:: O00204
Molecular weight:: 39598.595

Reactions

(S)-Naringenin 8-C-(2''-rhamnosylglucoside) → ({6-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-3,4-dihydro-2H-1-benzopyran-8-yl]-3,4-dihydroxy-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}methoxy)sulfonic acid	details
(S)-Naringenin 8-C-(2''-rhamnosylglucoside) → {6-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-3,4-dihydro-2H-1-benzopyran-8-yl]-4-hydroxy-2-(hydroxymethyl)-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-3-yl}oxidanesulfonic acid	details
(S)-Naringenin 8-C-(2''-rhamnosylglucoside) → {2-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-3,4-dihydro-2H-1-benzopyran-8-yl]-5-hydroxy-6-(hydroxymethyl)-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-4-yl}oxidanesulfonic acid	details

Enzyme Details

2. UDP-glucuronosyltransferase 1-1

General function:: Involved in transferase activity, transferring hexosyl groups
Specific function:: UDPGT is of major importance in the conjugation and subsequent elimination of potentially toxic xenobiotics and endogenous compounds. This isoform glucuronidates bilirubin IX-alpha to form both the IX-alpha-C8 and IX-alpha-C12 monoconjugates and diconjugate. Is also able to catalyze the glucuronidation of 17beta-estradiol, 17alpha-ethinylestradiol, 1-hydroxypyrene, 4-methylumbelliferone, 1-naphthol, paranitrophenol, scopoletin, and umbelliferone.
Gene Name:: UGT1A1
Uniprot ID:: P22309
Molecular weight:: 59590.91

Reactions

(S)-Naringenin 8-C-(2''-rhamnosylglucoside) → 6-(4-{8-[4,5-dihydroxy-6-(hydroxymethyl)-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl]-5,7-dihydroxy-4-oxo-3,4-dihydro-2H-1-benzopyran-2-yl}phenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid	details
(S)-Naringenin 8-C-(2''-rhamnosylglucoside) → 6-({8-[4,5-dihydroxy-6-(hydroxymethyl)-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl]-7-hydroxy-2-(4-hydroxyphenyl)-4-oxo-3,4-dihydro-2H-1-benzopyran-5-yl}oxy)-3,4,5-trihydroxyoxane-2-carboxylic acid	details
(S)-Naringenin 8-C-(2''-rhamnosylglucoside) → 6-({8-[4,5-dihydroxy-6-(hydroxymethyl)-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl]-5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-3,4-dihydro-2H-1-benzopyran-7-yl}oxy)-3,4,5-trihydroxyoxane-2-carboxylic acid	details

Enzyme Details

3. Sulfotransferase 1A3

General function:: sulfotransferase activity
Specific function:: Sulfotransferase that utilizes 3'-phospho-5'-adenylyl sulfate (PAPS) as sulfonate donor to catalyze the sulfate conjugation of phenolic monoamines (neurotransmitters such as dopamine, norepinephrine and serotonin) and phenolic and catechol drugs.
Gene Name:: SULT1A3
Uniprot ID:: P0DMM9
Molecular weight:: 34195.96

Reactions

(S)-Naringenin 8-C-(2''-rhamnosylglucoside) → (4-{8-[4,5-dihydroxy-6-(hydroxymethyl)-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl]-5,7-dihydroxy-4-oxo-3,4-dihydro-2H-1-benzopyran-2-yl}phenyl)oxidanesulfonic acid	details

Showing metabocard for (S)-Naringenin 8-C-(2''-rhamnosylglucoside) (HMDB0035426)

MOL for HMDB0035426 ((S)-Naringenin 8-C-(2''-rhamnosylglucoside))

3D MOL for HMDB0035426 ((S)-Naringenin 8-C-(2''-rhamnosylglucoside))

3D SDF for HMDB0035426 ((S)-Naringenin 8-C-(2''-rhamnosylglucoside))

3D-SDF for HMDB0035426 ((S)-Naringenin 8-C-(2''-rhamnosylglucoside))

PDB for HMDB0035426 ((S)-Naringenin 8-C-(2''-rhamnosylglucoside))

3D PDB for HMDB0035426 ((S)-Naringenin 8-C-(2''-rhamnosylglucoside))

SMILES for HMDB0035426 ((S)-Naringenin 8-C-(2''-rhamnosylglucoside))

INCHI for HMDB0035426 ((S)-Naringenin 8-C-(2''-rhamnosylglucoside))

Structure for HMDB0035426 ((S)-Naringenin 8-C-(2''-rhamnosylglucoside))

3D Structure for HMDB0035426 ((S)-Naringenin 8-C-(2''-rhamnosylglucoside))

Predicted Collision Cross Sections

Predicted Kovats Retention Indices

Underivatized

Derivatized

GC-MS Spectra

MS/MS Spectra

NMR Spectra

Enzymes

Reactions

Reactions

Reactions