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Identification Taxonomy Ontology Physical properties Spectra Biological properties Concentrations Links References enzymes (2) Show 2 proteins XML

Record Information

Version

5.0

Status

Expected but not Quantified

Creation Date

2012-09-11 17:44:11 UTC

Update Date

2022-03-07 02:53:02 UTC

HMDB ID

HMDB0031584

Secondary Accession Numbers

HMDB31584

Metabolite Identification

Common Name

Myricatomentoside II

Description

Myricatomentoside II belongs to the class of organic compounds known as meta,meta-bridged biphenyls. These are cyclic diarylheptanoids where the two aryl groups are linked to each other by an ether group conjugated to their 3-position. Myricatomentoside II is an extremely weak basic (essentially neutral) compound (based on its pKa). Outside of the human body, myricatomentoside II has been detected, but not quantified in, brassicas. This could make myricatomentoside II a potential biomarker for the consumption of these foods.

Structure

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


  Mrv0541 05061306012D          

 38 41  0  0  0  0            999 V2000
   -2.1438   -0.9882    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6071   -0.3055    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4299   -0.3654    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.5335    1.0598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9433    1.7759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5281    2.4887    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9378    3.2048    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2933    1.7695    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7031    2.4856    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2878    3.1985    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1754    2.1978    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
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 37 38  1  0  0  0  0
M  END

HMDB0031584
     RDKit          3D
Myricatomentoside II
 72 75  0  0  0  0  0  0  0  0999 V2000
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M  END


  Mrv0541 05061306012D          

 38 41  0  0  0  0            999 V2000
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 13 26  1  0  0  0  0
 14 15  1  0  0  0  0
 14 21  2  0  0  0  0
 15 16  2  0  0  0  0
 16 23  1  0  0  0  0
 17 18  1  0  0  0  0
 17 22  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 26 27  1  0  0  0  0
 26 31  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 28 32  1  0  0  0  0
 29 30  1  0  0  0  0
 29 36  1  0  0  0  0
 30 31  1  0  0  0  0
 30 35  1  0  0  0  0
 31 34  1  0  0  0  0
 32 33  1  0  0  0  0
 12 37  1  0  0  0  0
 11 38  1  0  0  0  0
 37 38  1  0  0  0  0
M  END
> <DATABASE_ID>
HMDB0031584

> <DATABASE_NAME>
hmdb

> <SMILES>
COC1=C(OC2OC(CO)C(O)C(O)C2O)C2=CC(=C1OC)C1=C(O)C=CC(CC(O)C(=O)CCCC2)=C1

> <INCHI_IDENTIFIER>
InChI=1S/C27H34O11/c1-35-25-16-11-14(5-3-4-6-18(30)19(31)10-13-7-8-17(29)15(16)9-13)24(26(25)36-2)38-27-23(34)22(33)21(32)20(12-28)37-27/h7-9,11,19-23,27-29,31-34H,3-6,10,12H2,1-2H3

> <INCHI_KEY>
BSILZSYJTIBPFN-UHFFFAOYSA-N

> <FORMULA>
C27H34O11

> <MOLECULAR_WEIGHT>
534.5523

> <EXACT_MASS>
534.21011193

> <JCHEM_ACCEPTOR_COUNT>
11

> <JCHEM_AVERAGE_POLARIZABILITY>
53.857535994496466

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
6

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
3,8-dihydroxy-16,17-dimethoxy-15-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}tricyclo[12.3.1.1²,⁶]nonadeca-1(17),2,4,6(19),14(18),15-hexaen-9-one

> <ALOGPS_LOGP>
0.45

> <JCHEM_LOGP>
1.1656064650000004

> <ALOGPS_LOGS>
-3.14

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
4

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
12.171745065713095

> <JCHEM_PKA_STRONGEST_ACIDIC>
8.996640645269549

> <JCHEM_PKA_STRONGEST_BASIC>
-2.981092356130998

> <JCHEM_POLAR_SURFACE_AREA>
175.37

> <JCHEM_REFRACTIVITY>
133.64559999999994

> <JCHEM_ROTATABLE_BOND_COUNT>
5

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
3.86e-01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
3,8-dihydroxy-16,17-dimethoxy-15-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}tricyclo[12.3.1.1²,⁶]nonadeca-1(17),2,4,6(19),14(18),15-hexaen-9-one

> <JCHEM_VEBER_RULE>
0

$$$$

HMDB0031584
     RDKit          3D
Myricatomentoside II
 72 75  0  0  0  0  0  0  0  0999 V2000
    1.7032   -1.3084   -3.0701 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0499   -2.3789   -2.1940 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7259   -2.0732   -0.8964 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6055   -2.6693   -0.3119 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3148   -2.3787    1.0359 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9112   -1.3099    1.7016 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0234   -0.7105    1.1029 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6741    0.2879    1.7803 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5271    1.5634    1.1347 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4437    2.2918    1.7292 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1989    3.5935    1.1668 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6260    3.5356   -0.2627 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6004    2.8114   -0.2841 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4658    4.4600    1.2407 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7504    4.7996    2.6117 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6923    3.7280    0.6682 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8718    4.5047    0.9308 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8512    2.3396    1.2970 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1983    2.5097    2.6897 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4888   -1.1623   -0.1478 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6265   -0.5910   -0.6721 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7064   -1.5230   -0.5820 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1933   -0.7384    2.9090 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0265    0.1175    2.4801 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3326   -0.6675    2.2157 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1861   -0.0173    1.1241 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5253   -0.6936    0.8592 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5725   -0.0719    1.0813 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6068   -2.1308    0.2937 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0221   -3.1032    1.1453 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1727   -2.2701   -1.1912 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9174   -3.0759   -1.4426 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9376   -4.3942   -1.9048 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7524   -5.1468   -1.9690 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5438   -4.6081   -1.5135 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5811   -5.3799   -1.4646 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4992   -3.2970   -1.0527 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6842   -2.5300   -1.1078 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4281   -0.4918   -2.9979 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7333   -1.6928   -4.0941 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6906   -0.9338   -2.8811 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5283   -2.8906    1.4986 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3184    1.4452    0.0657 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4315    4.0313    1.8168 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4248    4.5489   -0.6261 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3081    3.0485   -0.9641 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9561    2.8649   -1.1875 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3221    5.4153    0.7244 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8420    3.9447    3.0922 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5976    3.6300   -0.4187 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6780    4.9997    1.7556 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6797    1.7867    0.8402 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1075    2.8646    2.6873 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6218   -0.9988   -0.8725 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8371   -1.8858    0.4440 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5675   -2.3628   -1.2703 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8854   -0.1140    3.4856 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1186   -1.5467    3.5814 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2355    0.8397    3.2797 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7621    0.7071    1.5947 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9093   -0.7244    3.1474 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1277   -1.6984    1.9394 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4045    1.0158    1.4253 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6474    0.0616    0.1775 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6834   -2.3558    0.3003 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5406   -3.1153    1.9695 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9930   -2.7539   -1.7392 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0721   -1.2818   -1.6581 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8775   -4.8635   -2.1864 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8055   -6.1734   -2.3196 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3787   -6.2543   -1.8316 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6370   -1.4998   -0.7688 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  1  0
 11 14  1  0
 14 15  1  0
 14 16  1  0
 16 17  1  0
 16 18  1  0
 18 19  1  0
  7 20  2  0
 20 21  1  0
 21 22  1  0
  6 23  1  0
 23 24  1  0
 24 25  1  0
 25 26  1  0
 26 27  1  0
 27 28  2  0
 27 29  1  0
 29 30  1  0
 29 31  1  0
 31 32  1  0
 32 33  1  0
 33 34  2  0
 34 35  1  0
 35 36  1  0
 35 37  2  0
 37 38  1  0
 20  3  1  0
 38 32  2  0
 37  4  1  0
 18  9  1  0
  1 39  1  0
  1 40  1  0
  1 41  1  0
  5 42  1  0
  9 43  1  0
 11 44  1  0
 12 45  1  0
 12 46  1  0
 13 47  1  0
 14 48  1  0
 15 49  1  0
 16 50  1  0
 17 51  1  0
 18 52  1  0
 19 53  1  0
 22 54  1  0
 22 55  1  0
 22 56  1  0
 23 57  1  0
 23 58  1  0
 24 59  1  0
 24 60  1  0
 25 61  1  0
 25 62  1  0
 26 63  1  0
 26 64  1  0
 29 65  1  0
 30 66  1  0
 31 67  1  0
 31 68  1  0
 33 69  1  0
 34 70  1  0
 36 71  1  0
 38 72  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  O   UNK     0      -4.002  -1.845   0.000  0.00  0.00           O+0
HETATM    2  C   UNK     0      -4.867  -0.570   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      -6.402  -0.682   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      -7.267   0.592   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      -6.596   1.978   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0      -7.361   3.315   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0      -6.586   4.646   0.000  0.00  0.00           C+0
HETATM    8  O   UNK     0      -7.351   5.982   0.000  0.00  0.00           O+0
HETATM    9  O   UNK     0      -4.281   3.303   0.000  0.00  0.00           O+0
HETATM   10  C   UNK     0      -5.046   4.640   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      -4.271   5.971   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      -0.327   4.103   0.000  0.00  0.00           C+0
HETATM   13  O   UNK     0       1.948   1.262   0.000  0.00  0.00           O+0
HETATM   14  C   UNK     0       0.413   1.151   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0      -0.452   2.425   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0      -1.988   2.313   0.000  0.00  0.00           C+0
HETATM   17  O   UNK     0      -2.466  -1.733   0.000  0.00  0.00           O+0
HETATM   18  C   UNK     0      -1.931  -3.117   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0       0.210  -3.006   0.000  0.00  0.00           C+0
HETATM   20  O   UNK     0       0.606  -1.510   0.000  0.00  0.00           O+0
HETATM   21  C   UNK     0      -0.259  -0.235   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0      -1.795  -0.347   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0      -2.659   0.927   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0      -4.195   0.816   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0      -5.060   2.090   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0       2.813  -0.012   0.000  0.00  0.00           C+0
HETATM   27  O   UNK     0       2.142  -1.398   0.000  0.00  0.00           O+0
HETATM   28  C   UNK     0       3.007  -2.672   0.000  0.00  0.00           C+0
HETATM   29  C   UNK     0       4.543  -2.561   0.000  0.00  0.00           C+0
HETATM   30  C   UNK     0       5.214  -1.175   0.000  0.00  0.00           C+0
HETATM   31  C   UNK     0       4.349   0.100   0.000  0.00  0.00           C+0
HETATM   32  C   UNK     0       2.335  -4.058   0.000  0.00  0.00           C+0
HETATM   33  O   UNK     0       0.799  -4.170   0.000  0.00  0.00           O+0
HETATM   34  O   UNK     0       5.020   1.486   0.000  0.00  0.00           O+0
HETATM   35  O   UNK     0       6.750  -1.063   0.000  0.00  0.00           O+0
HETATM   36  O   UNK     0       5.407  -3.835   0.000  0.00  0.00           O+0
HETATM   37  C   UNK     0      -1.989   4.554   0.000  0.00  0.00           C+0
HETATM   38  C   UNK     0      -2.731   5.965   0.000  0.00  0.00           C+0
CONECT    1    2                                                            
CONECT    2    1    3   24                                                  
CONECT    3    2    4                                                       
CONECT    4    3    5                                                       
CONECT    5    4    6   25                                                  
CONECT    6    5    7                                                       
CONECT    7    6    8   10                                                  
CONECT    8    7                                                            
CONECT    9   10                                                            
CONECT   10    7    9   11                                                  
CONECT   11   10   38                                                       
CONECT   12   15   37                                                       
CONECT   13   14   26                                                       
CONECT   14   13   15   21                                                  
CONECT   15   12   14   16                                                  
CONECT   16   15   23                                                       
CONECT   17   18   22                                                       
CONECT   18   17                                                            
CONECT   19   20                                                            
CONECT   20   19   21                                                       
CONECT   21   14   20   22                                                  
CONECT   22   17   21   23                                                  
CONECT   23   16   22   24                                                  
CONECT   24    2   23   25                                                  
CONECT   25    5   24                                                       
CONECT   26   13   27   31                                                  
CONECT   27   26   28                                                       
CONECT   28   27   29   32                                                  
CONECT   29   28   30   36                                                  
CONECT   30   29   31   35                                                  
CONECT   31   26   30   34                                                  
CONECT   32   28   33                                                       
CONECT   33   32                                                            
CONECT   34   31                                                            
CONECT   35   30                                                            
CONECT   36   29                                                            
CONECT   37   12   38                                                       
CONECT   38   11   37                                                       
MASTER        0    0    0    0    0    0    0    0   38    0   82    0
END

COMPND    HMDB0031584
HETATM    1  C1  UNL     1       1.703  -1.308  -3.070  1.00  0.00           C  
HETATM    2  O1  UNL     1       2.050  -2.379  -2.194  1.00  0.00           O  
HETATM    3  C2  UNL     1       1.726  -2.073  -0.896  1.00  0.00           C  
HETATM    4  C3  UNL     1       0.605  -2.669  -0.312  1.00  0.00           C  
HETATM    5  C4  UNL     1       0.315  -2.379   1.036  1.00  0.00           C  
HETATM    6  C5  UNL     1       0.911  -1.310   1.702  1.00  0.00           C  
HETATM    7  C6  UNL     1       2.023  -0.711   1.103  1.00  0.00           C  
HETATM    8  O2  UNL     1       2.674   0.288   1.780  1.00  0.00           O  
HETATM    9  C7  UNL     1       2.527   1.563   1.135  1.00  0.00           C  
HETATM   10  O3  UNL     1       1.444   2.292   1.729  1.00  0.00           O  
HETATM   11  C8  UNL     1       1.199   3.593   1.167  1.00  0.00           C  
HETATM   12  C9  UNL     1       0.626   3.536  -0.263  1.00  0.00           C  
HETATM   13  O4  UNL     1      -0.600   2.811  -0.284  1.00  0.00           O  
HETATM   14  C10 UNL     1       2.466   4.460   1.241  1.00  0.00           C  
HETATM   15  O5  UNL     1       2.750   4.800   2.612  1.00  0.00           O  
HETATM   16  C11 UNL     1       3.692   3.728   0.668  1.00  0.00           C  
HETATM   17  O6  UNL     1       4.872   4.505   0.931  1.00  0.00           O  
HETATM   18  C12 UNL     1       3.851   2.340   1.297  1.00  0.00           C  
HETATM   19  O7  UNL     1       4.198   2.510   2.690  1.00  0.00           O  
HETATM   20  C13 UNL     1       2.489  -1.162  -0.148  1.00  0.00           C  
HETATM   21  O8  UNL     1       3.626  -0.591  -0.672  1.00  0.00           O  
HETATM   22  C14 UNL     1       4.706  -1.523  -0.582  1.00  0.00           C  
HETATM   23  C15 UNL     1       0.193  -0.738   2.909  1.00  0.00           C  
HETATM   24  C16 UNL     1      -1.027   0.118   2.480  1.00  0.00           C  
HETATM   25  C17 UNL     1      -2.333  -0.667   2.216  1.00  0.00           C  
HETATM   26  C18 UNL     1      -3.186  -0.017   1.124  1.00  0.00           C  
HETATM   27  C19 UNL     1      -4.525  -0.694   0.859  1.00  0.00           C  
HETATM   28  O9  UNL     1      -5.572  -0.072   1.081  1.00  0.00           O  
HETATM   29  C20 UNL     1      -4.607  -2.131   0.294  1.00  0.00           C  
HETATM   30  O10 UNL     1      -4.022  -3.103   1.145  1.00  0.00           O  
HETATM   31  C21 UNL     1      -4.173  -2.270  -1.191  1.00  0.00           C  
HETATM   32  C22 UNL     1      -2.917  -3.076  -1.443  1.00  0.00           C  
HETATM   33  C23 UNL     1      -2.938  -4.394  -1.905  1.00  0.00           C  
HETATM   34  C24 UNL     1      -1.752  -5.147  -1.969  1.00  0.00           C  
HETATM   35  C25 UNL     1      -0.544  -4.608  -1.514  1.00  0.00           C  
HETATM   36  O11 UNL     1       0.581  -5.380  -1.465  1.00  0.00           O  
HETATM   37  C26 UNL     1      -0.499  -3.297  -1.053  1.00  0.00           C  
HETATM   38  C27 UNL     1      -1.684  -2.530  -1.108  1.00  0.00           C  
HETATM   39  H1  UNL     1       2.428  -0.492  -2.998  1.00  0.00           H  
HETATM   40  H2  UNL     1       1.733  -1.693  -4.094  1.00  0.00           H  
HETATM   41  H3  UNL     1       0.691  -0.934  -2.881  1.00  0.00           H  
HETATM   42  H4  UNL     1      -0.528  -2.891   1.499  1.00  0.00           H  
HETATM   43  H5  UNL     1       2.318   1.445   0.066  1.00  0.00           H  
HETATM   44  H6  UNL     1       0.431   4.031   1.817  1.00  0.00           H  
HETATM   45  H7  UNL     1       0.425   4.549  -0.626  1.00  0.00           H  
HETATM   46  H8  UNL     1       1.308   3.049  -0.964  1.00  0.00           H  
HETATM   47  H9  UNL     1      -0.956   2.865  -1.187  1.00  0.00           H  
HETATM   48  H10 UNL     1       2.322   5.415   0.724  1.00  0.00           H  
HETATM   49  H11 UNL     1       2.842   3.945   3.092  1.00  0.00           H  
HETATM   50  H12 UNL     1       3.598   3.630  -0.419  1.00  0.00           H  
HETATM   51  H13 UNL     1       4.678   5.000   1.756  1.00  0.00           H  
HETATM   52  H14 UNL     1       4.680   1.787   0.840  1.00  0.00           H  
HETATM   53  H15 UNL     1       5.108   2.865   2.687  1.00  0.00           H  
HETATM   54  H16 UNL     1       5.622  -0.999  -0.872  1.00  0.00           H  
HETATM   55  H17 UNL     1       4.837  -1.886   0.444  1.00  0.00           H  
HETATM   56  H18 UNL     1       4.567  -2.363  -1.270  1.00  0.00           H  
HETATM   57  H19 UNL     1       0.885  -0.114   3.486  1.00  0.00           H  
HETATM   58  H20 UNL     1      -0.119  -1.547   3.581  1.00  0.00           H  
HETATM   59  H21 UNL     1      -1.236   0.840   3.280  1.00  0.00           H  
HETATM   60  H22 UNL     1      -0.762   0.707   1.595  1.00  0.00           H  
HETATM   61  H23 UNL     1      -2.909  -0.724   3.147  1.00  0.00           H  
HETATM   62  H24 UNL     1      -2.128  -1.698   1.939  1.00  0.00           H  
HETATM   63  H25 UNL     1      -3.404   1.016   1.425  1.00  0.00           H  
HETATM   64  H26 UNL     1      -2.647   0.062   0.178  1.00  0.00           H  
HETATM   65  H27 UNL     1      -5.683  -2.356   0.300  1.00  0.00           H  
HETATM   66  H28 UNL     1      -4.541  -3.115   1.970  1.00  0.00           H  
HETATM   67  H29 UNL     1      -4.993  -2.754  -1.739  1.00  0.00           H  
HETATM   68  H30 UNL     1      -4.072  -1.282  -1.658  1.00  0.00           H  
HETATM   69  H31 UNL     1      -3.877  -4.863  -2.186  1.00  0.00           H  
HETATM   70  H32 UNL     1      -1.805  -6.173  -2.320  1.00  0.00           H  
HETATM   71  H33 UNL     1       0.379  -6.254  -1.832  1.00  0.00           H  
HETATM   72  H34 UNL     1      -1.637  -1.500  -0.769  1.00  0.00           H  
CONECT    1    2   39   40   41
CONECT    2    3
CONECT    3    4    4   20
CONECT    4    5   37
CONECT    5    6    6   42
CONECT    6    7   23
CONECT    7    8   20   20
CONECT    8    9
CONECT    9   10   18   43
CONECT   10   11
CONECT   11   12   14   44
CONECT   12   13   45   46
CONECT   13   47
CONECT   14   15   16   48
CONECT   15   49
CONECT   16   17   18   50
CONECT   17   51
CONECT   18   19   52
CONECT   19   53
CONECT   20   21
CONECT   21   22
CONECT   22   54   55   56
CONECT   23   24   57   58
CONECT   24   25   59   60
CONECT   25   26   61   62
CONECT   26   27   63   64
CONECT   27   28   28   29
CONECT   29   30   31   65
CONECT   30   66
CONECT   31   32   67   68
CONECT   32   33   38   38
CONECT   33   34   34   69
CONECT   34   35   70
CONECT   35   36   37   37
CONECT   36   71
CONECT   37   38
CONECT   38   72
END

HMDB0031584
     RDKit          3D
Myricatomentoside II
 72 75  0  0  0  0  0  0  0  0999 V2000
    1.7032   -1.3084   -3.0701 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0499   -2.3789   -2.1940 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7259   -2.0732   -0.8964 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6055   -2.6693   -0.3119 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3148   -2.3787    1.0359 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9112   -1.3099    1.7016 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0234   -0.7105    1.1029 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6741    0.2879    1.7803 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5271    1.5634    1.1347 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4437    2.2918    1.7292 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1989    3.5935    1.1668 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6260    3.5356   -0.2627 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6004    2.8114   -0.2841 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4658    4.4600    1.2407 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7504    4.7996    2.6117 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6923    3.7280    0.6682 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8718    4.5047    0.9308 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8512    2.3396    1.2970 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1983    2.5097    2.6897 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4888   -1.1623   -0.1478 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6265   -0.5910   -0.6721 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7064   -1.5230   -0.5820 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1933   -0.7384    2.9090 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0265    0.1175    2.4801 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3326   -0.6675    2.2157 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1861   -0.0173    1.1241 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5253   -0.6936    0.8592 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5725   -0.0719    1.0813 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6068   -2.1308    0.2937 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0221   -3.1032    1.1453 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1727   -2.2701   -1.1912 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9174   -3.0759   -1.4426 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9376   -4.3942   -1.9048 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7524   -5.1468   -1.9690 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5438   -4.6081   -1.5135 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5811   -5.3799   -1.4646 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4992   -3.2970   -1.0527 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6842   -2.5300   -1.1078 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4281   -0.4918   -2.9979 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7333   -1.6928   -4.0941 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6906   -0.9338   -2.8811 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5283   -2.8906    1.4986 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3184    1.4452    0.0657 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4315    4.0313    1.8168 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4248    4.5489   -0.6261 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3081    3.0485   -0.9641 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9561    2.8649   -1.1875 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3221    5.4153    0.7244 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8420    3.9447    3.0922 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5976    3.6300   -0.4187 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6780    4.9997    1.7556 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6797    1.7867    0.8402 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1075    2.8646    2.6873 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6218   -0.9988   -0.8725 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8371   -1.8858    0.4440 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5675   -2.3628   -1.2703 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8854   -0.1140    3.4856 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1186   -1.5467    3.5814 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2355    0.8397    3.2797 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7621    0.7071    1.5947 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9093   -0.7244    3.1474 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1277   -1.6984    1.9394 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4045    1.0158    1.4253 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6474    0.0616    0.1775 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6834   -2.3558    0.3003 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5406   -3.1153    1.9695 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9930   -2.7539   -1.7392 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0721   -1.2818   -1.6581 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8775   -4.8635   -2.1864 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8055   -6.1734   -2.3196 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3787   -6.2543   -1.8316 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6370   -1.4998   -0.7688 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  1  0
 11 14  1  0
 14 15  1  0
 14 16  1  0
 16 17  1  0
 16 18  1  0
 18 19  1  0
  7 20  2  0
 20 21  1  0
 21 22  1  0
  6 23  1  0
 23 24  1  0
 24 25  1  0
 25 26  1  0
 26 27  1  0
 27 28  2  0
 27 29  1  0
 29 30  1  0
 29 31  1  0
 31 32  1  0
 32 33  1  0
 33 34  2  0
 34 35  1  0
 35 36  1  0
 35 37  2  0
 37 38  1  0
 20  3  1  0
 38 32  2  0
 37  4  1  0
 18  9  1  0
  1 39  1  0
  1 40  1  0
  1 41  1  0
  5 42  1  0
  9 43  1  0
 11 44  1  0
 12 45  1  0
 12 46  1  0
 13 47  1  0
 14 48  1  0
 15 49  1  0
 16 50  1  0
 17 51  1  0
 18 52  1  0
 19 53  1  0
 22 54  1  0
 22 55  1  0
 22 56  1  0
 23 57  1  0
 23 58  1  0
 24 59  1  0
 24 60  1  0
 25 61  1  0
 25 62  1  0
 26 63  1  0
 26 64  1  0
 29 65  1  0
 30 66  1  0
 31 67  1  0
 31 68  1  0
 33 69  1  0
 34 70  1  0
 36 71  1  0
 38 72  1  0
M  END

View in JSmol View Stereo Labels

Synonyms

Not Available

Chemical Formula

C₂₇H₃₄O₁₁

Average Molecular Weight

534.5523

Monoisotopic Molecular Weight

534.21011193

IUPAC Name

3,8-dihydroxy-16,17-dimethoxy-15-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}tricyclo[12.3.1.1²,⁶]nonadeca-1(17),2,4,6(19),14(18),15-hexaen-9-one

Traditional Name

3,8-dihydroxy-16,17-dimethoxy-15-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}tricyclo[12.3.1.1²,⁶]nonadeca-1(17),2,4,6(19),14(18),15-hexaen-9-one

CAS Registry Number

191999-63-0

SMILES

COC1=C(OC2OC(CO)C(O)C(O)C2O)C2=CC(=C1OC)C1=C(O)C=CC(CC(O)C(=O)CCCC2)=C1

InChI Identifier

InChI=1S/C27H34O11/c1-35-25-16-11-14(5-3-4-6-18(30)19(31)10-13-7-8-17(29)15(16)9-13)24(26(25)36-2)38-27-23(34)22(33)21(32)20(12-28)37-27/h7-9,11,19-23,27-29,31-34H,3-6,10,12H2,1-2H3

InChI Key

BSILZSYJTIBPFN-UHFFFAOYSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as meta,meta-bridged biphenyls. These are cyclic diarylheptanoids where the two aryl groups are linked to each other by an ether group conjugated to their 3-position.

Kingdom

Organic compounds

Super Class

Phenylpropanoids and polyketides

Class

Diarylheptanoids

Sub Class

Cyclic diarylheptanoids

Direct Parent

Meta,meta-bridged biphenyls

Alternative Parents

Not Available

Substituents

Not Available

Molecular Framework

Aromatic heteropolycyclic compounds

External Descriptors

Not Available

Ontology

Physiological effect

Not Available

Disposition

Biological location

Cellular substructure

Extracellular (HMDB: HMDB0031584)
Cytoplasm (HMDB: HMDB0031584)

Route of exposure

Enteral

Ingestion (HMDB: HMDB0031584)

Source

Endogenous

Endogenous (HMDB: HMDB0031584)

Plant

Plant (HMDB: HMDB0031584)

Exogenous

Food

Food (HMDB: HMDB0031584)

Vegetable

Brassica

Brassicas (FooDB: FOOD00857)

Process

Not Available

Role

Not Available

Physical Properties

State

Solid

Experimental Molecular Properties

Property	Value	Reference
Melting Point	148 - 150 °C	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	0.39 g/L	ALOGPS
logP	0.45	ALOGPS
logP	1.17	ChemAxon
logS	-3.1	ALOGPS
pKa (Strongest Acidic)	9	ChemAxon
pKa (Strongest Basic)	-3	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	11	ChemAxon
Hydrogen Donor Count	6	ChemAxon
Polar Surface Area	175.37 Å²	ChemAxon
Rotatable Bond Count	5	ChemAxon
Refractivity	133.65 m³·mol⁻¹	ChemAxon
Polarizability	53.86 Å³	ChemAxon
Number of Rings	4	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]+	220.487	31661259
DarkChem	[M-H]-	217.194	31661259
DeepCCS	[M+H]+	226.555	30932474
DeepCCS	[M-H]-	224.159	30932474
DeepCCS	[M-2H]-	257.044	30932474
DeepCCS	[M+Na]+	232.467	30932474
AllCCS	[M+H]+	222.8	32859911
AllCCS	[M+H-H2O]+	221.3	32859911
AllCCS	[M+NH4]+	224.2	32859911
AllCCS	[M+Na]+	224.6	32859911
AllCCS	[M-H]-	214.4	32859911
AllCCS	[M+Na-2H]-	216.1	32859911
AllCCS	[M+HCOO]-	218.0	32859911

Predicted Kovats Retention Indices

Underivatized

Metabolite	SMILES	Kovats RI Value	Column Type	Reference
Myricatomentoside II	COC1=C(OC2OC(CO)C(O)C(O)C2O)C2=CC(=C1OC)C1=C(O)C=CC(CC(O)C(=O)CCCC2)=C1	4225.1	Standard polar	33892256
Myricatomentoside II	COC1=C(OC2OC(CO)C(O)C(O)C2O)C2=CC(=C1OC)C1=C(O)C=CC(CC(O)C(=O)CCCC2)=C1	4385.3	Standard non polar	33892256
Myricatomentoside II	COC1=C(OC2OC(CO)C(O)C(O)C2O)C2=CC(=C1OC)C1=C(O)C=CC(CC(O)C(=O)CCCC2)=C1	4429.8	Semi standard non polar	33892256

Derivatized

Derivative Name / Structure	SMILES	Kovats RI Value	Column Type	Reference
Myricatomentoside II,1TMS,isomer #1	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)=C1OC	4552.2	Semi standard non polar	33892256
Myricatomentoside II,1TMS,isomer #2	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)=C1OC	4516.6	Semi standard non polar	33892256
Myricatomentoside II,1TMS,isomer #3	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)=C1OC	4511.2	Semi standard non polar	33892256
Myricatomentoside II,1TMS,isomer #4	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)=C1OC	4527.5	Semi standard non polar	33892256
Myricatomentoside II,1TMS,isomer #5	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O)C(O)C2O)=C1OC	4566.8	Semi standard non polar	33892256
Myricatomentoside II,1TMS,isomer #6	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O)C(O)C2O)=C1OC	4527.5	Semi standard non polar	33892256
Myricatomentoside II,1TMS,isomer #7	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O)C(O)C2O)=C1OC	4415.9	Semi standard non polar	33892256
Myricatomentoside II,1TMS,isomer #8	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O)C(O)C2O)=C1OC	4537.9	Semi standard non polar	33892256
Myricatomentoside II,2TMS,isomer #1	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)=C1OC	4437.2	Semi standard non polar	33892256
Myricatomentoside II,2TMS,isomer #10	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)=C1OC	4395.4	Semi standard non polar	33892256
Myricatomentoside II,2TMS,isomer #11	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)=C1OC	4449.3	Semi standard non polar	33892256
Myricatomentoside II,2TMS,isomer #12	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)=C1OC	4325.1	Semi standard non polar	33892256
Myricatomentoside II,2TMS,isomer #13	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)=C1OC	4403.8	Semi standard non polar	33892256
Myricatomentoside II,2TMS,isomer #14	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=C1OC	4418.1	Semi standard non polar	33892256
Myricatomentoside II,2TMS,isomer #15	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)=C1OC	4375.6	Semi standard non polar	33892256
Myricatomentoside II,2TMS,isomer #16	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)=C1OC	4416.3	Semi standard non polar	33892256
Myricatomentoside II,2TMS,isomer #17	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)=C1OC	4297.0	Semi standard non polar	33892256
Myricatomentoside II,2TMS,isomer #18	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)=C1OC	4381.6	Semi standard non polar	33892256
Myricatomentoside II,2TMS,isomer #19	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)=C1OC	4396.7	Semi standard non polar	33892256
Myricatomentoside II,2TMS,isomer #2	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)=C1OC	4415.3	Semi standard non polar	33892256
Myricatomentoside II,2TMS,isomer #20	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)=C1OC	4448.1	Semi standard non polar	33892256
Myricatomentoside II,2TMS,isomer #21	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)=C1OC	4329.1	Semi standard non polar	33892256
Myricatomentoside II,2TMS,isomer #22	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)=C1OC	4406.4	Semi standard non polar	33892256
Myricatomentoside II,2TMS,isomer #23	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O)C(O)C2O)=C1OC	4436.4	Semi standard non polar	33892256
Myricatomentoside II,2TMS,isomer #24	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O)C(O)C2O)=C1OC	4349.6	Semi standard non polar	33892256
Myricatomentoside II,2TMS,isomer #25	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O)C(O)C2O)=C1OC	4449.6	Semi standard non polar	33892256
Myricatomentoside II,2TMS,isomer #26	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O)C(O)C2O)=C1OC	4331.4	Semi standard non polar	33892256
Myricatomentoside II,2TMS,isomer #27	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O)C(O)C2O)=C1OC	4432.1	Semi standard non polar	33892256
Myricatomentoside II,2TMS,isomer #3	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)=C1OC	4446.8	Semi standard non polar	33892256
Myricatomentoside II,2TMS,isomer #4	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)=C1OC	4403.0	Semi standard non polar	33892256
Myricatomentoside II,2TMS,isomer #5	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)=C1OC	4452.9	Semi standard non polar	33892256
Myricatomentoside II,2TMS,isomer #6	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)=C1OC	4319.2	Semi standard non polar	33892256
Myricatomentoside II,2TMS,isomer #7	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)=C1OC	4410.4	Semi standard non polar	33892256
Myricatomentoside II,2TMS,isomer #8	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=C1OC	4412.8	Semi standard non polar	33892256
Myricatomentoside II,2TMS,isomer #9	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=C1OC	4413.4	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #1	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=C1OC	4353.4	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #10	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)=C1OC	4248.7	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #11	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)=C1OC	4290.8	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #12	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)=C1OC	4326.4	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #13	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)=C1OC	4371.0	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #14	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)=C1OC	4290.2	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #15	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)=C1OC	4336.9	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #16	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)=C1OC	4318.8	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #17	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)=C1OC	4241.5	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #18	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)=C1OC	4313.1	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #19	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)=C1OC	4277.5	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #2	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=C1OC	4392.4	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #20	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)=C1OC	4331.4	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #21	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=C1OC	4358.7	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #22	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=C1OC	4296.6	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #23	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=C1OC	4326.6	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #24	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=C1OC	4253.9	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #25	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=C1OC	4300.0	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #26	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=C1OC	4299.5	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #27	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=C1OC	4338.1	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #28	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=C1OC	4258.5	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #29	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=C1OC	4309.0	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #3	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)=C1OC	4313.9	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #30	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)=C1OC	4310.5	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #31	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)=C1OC	4258.8	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #32	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)=C1OC	4321.9	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #33	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)=C1OC	4272.5	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #34	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)=C1OC	4327.6	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #35	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=C1OC	4306.5	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #36	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=C1OC	4336.4	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #37	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=C1OC	4262.0	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #38	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=C1OC	4317.3	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #39	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)=C1OC	4282.1	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #4	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)=C1OC	4358.8	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #40	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)=C1OC	4218.6	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #41	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)=C1OC	4293.5	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #42	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)=C1OC	4240.9	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #43	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)=C1OC	4280.1	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #44	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)=C1OC	4307.9	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #45	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)=C1OC	4265.5	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #46	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)=C1OC	4325.9	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #47	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)=C1OC	4275.7	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #48	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)=C1OC	4333.0	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #49	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O)C(O)C2O)=C1OC	4278.3	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #5	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)=C1OC	4274.7	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #50	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O)C(O)C2O)=C1OC	4350.0	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #6	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)=C1OC	4321.2	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #7	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=C1OC	4364.4	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #8	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)=C1OC	4292.5	Semi standard non polar	33892256
Myricatomentoside II,3TMS,isomer #9	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)=C1OC	4332.5	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #1	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=C1OC	4344.0	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #10	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)=C1OC	4228.3	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #11	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)=C1OC	4213.6	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #12	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)=C1OC	4242.6	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #13	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)=C1OC	4218.1	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #14	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)=C1OC	4250.2	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #15	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=C1OC	4249.8	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #16	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=C1OC	4275.2	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #17	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=C1OC	4231.7	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #18	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=C1OC	4268.1	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #19	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)=C1OC	4209.6	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #2	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=C1OC	4236.3	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #20	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)=C1OC	4186.0	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #21	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)=C1OC	4208.3	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #22	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)=C1OC	4188.2	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #23	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)=C1OC	4215.4	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #24	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)=C1OC	4246.4	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #25	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)=C1OC	4232.5	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #26	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)=C1OC	4255.8	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #27	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)=C1OC	4237.0	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #28	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)=C1OC	4268.8	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #29	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)=C1OC	4214.1	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #3	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=C1OC	4266.9	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #30	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)=C1OC	4234.3	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #31	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=C1OC	4246.5	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #32	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=C1OC	4278.0	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #33	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=C1OC	4237.6	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #34	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=C1OC	4274.6	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #35	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=C1OC	4199.3	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #36	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=C1OC	4181.8	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #37	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=C1OC	4218.5	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #38	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=C1OC	4189.8	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #39	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=C1OC	4222.4	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #4	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=C1OC	4224.9	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #40	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=C1OC	4216.8	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #41	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=C1OC	4199.0	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #42	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=C1OC	4228.7	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #43	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=C1OC	4205.6	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #44	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=C1OC	4235.7	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #45	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)=C1OC	4222.5	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #46	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)=C1OC	4236.6	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #47	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=C1OC	4210.9	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #48	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=C1OC	4193.4	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #49	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=C1OC	4234.3	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #5	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=C1OC	4256.7	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #50	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=C1OC	4198.7	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #51	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=C1OC	4234.9	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #52	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)=C1OC	4192.0	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #53	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)=C1OC	4199.9	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #54	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)=C1OC	4225.2	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #55	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)=C1OC	4241.6	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #6	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=C1OC	4279.0	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #7	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=C1OC	4302.4	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #8	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=C1OC	4260.7	Semi standard non polar	33892256
Myricatomentoside II,4TMS,isomer #9	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=C1OC	4296.8	Semi standard non polar	33892256
Myricatomentoside II,5TMS,isomer #1	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=C1OC	4236.8	Semi standard non polar	33892256
Myricatomentoside II,5TMS,isomer #10	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=C1OC	4200.5	Semi standard non polar	33892256
Myricatomentoside II,5TMS,isomer #11	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=C1OC	4208.3	Semi standard non polar	33892256
Myricatomentoside II,5TMS,isomer #12	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=C1OC	4225.2	Semi standard non polar	33892256
Myricatomentoside II,5TMS,isomer #13	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=C1OC	4204.5	Semi standard non polar	33892256
Myricatomentoside II,5TMS,isomer #14	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=C1OC	4223.6	Semi standard non polar	33892256
Myricatomentoside II,5TMS,isomer #15	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)=C1OC	4174.5	Semi standard non polar	33892256
Myricatomentoside II,5TMS,isomer #16	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)=C1OC	4173.8	Semi standard non polar	33892256
Myricatomentoside II,5TMS,isomer #17	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=C1OC	4175.2	Semi standard non polar	33892256
Myricatomentoside II,5TMS,isomer #18	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=C1OC	4182.7	Semi standard non polar	33892256
Myricatomentoside II,5TMS,isomer #19	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=C1OC	4197.7	Semi standard non polar	33892256
Myricatomentoside II,5TMS,isomer #2	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=C1OC	4257.7	Semi standard non polar	33892256
Myricatomentoside II,5TMS,isomer #20	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=C1OC	4180.9	Semi standard non polar	33892256
Myricatomentoside II,5TMS,isomer #21	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=C1OC	4200.0	Semi standard non polar	33892256
Myricatomentoside II,5TMS,isomer #22	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)=C1OC	4149.3	Semi standard non polar	33892256
Myricatomentoside II,5TMS,isomer #23	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)=C1OC	4150.4	Semi standard non polar	33892256
Myricatomentoside II,5TMS,isomer #24	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)=C1OC	4188.7	Semi standard non polar	33892256
Myricatomentoside II,5TMS,isomer #25	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)=C1OC	4187.2	Semi standard non polar	33892256
Myricatomentoside II,5TMS,isomer #26	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=C1OC	4159.0	Semi standard non polar	33892256
Myricatomentoside II,5TMS,isomer #27	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=C1OC	4169.9	Semi standard non polar	33892256
Myricatomentoside II,5TMS,isomer #28	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=C1OC	4191.1	Semi standard non polar	33892256
Myricatomentoside II,5TMS,isomer #29	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=C1OC	4169.7	Semi standard non polar	33892256
Myricatomentoside II,5TMS,isomer #3	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=C1OC	4241.5	Semi standard non polar	33892256
Myricatomentoside II,5TMS,isomer #30	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=C1OC	4189.8	Semi standard non polar	33892256
Myricatomentoside II,5TMS,isomer #31	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=C1OC	4134.3	Semi standard non polar	33892256
Myricatomentoside II,5TMS,isomer #32	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=C1OC	4142.3	Semi standard non polar	33892256
Myricatomentoside II,5TMS,isomer #33	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=C1OC	4150.3	Semi standard non polar	33892256
Myricatomentoside II,5TMS,isomer #34	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=C1OC	4162.8	Semi standard non polar	33892256
Myricatomentoside II,5TMS,isomer #35	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=C1OC	4143.1	Semi standard non polar	33892256
Myricatomentoside II,5TMS,isomer #36	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=C1OC	4154.8	Semi standard non polar	33892256
Myricatomentoside II,5TMS,isomer #4	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=C1OC	4263.3	Semi standard non polar	33892256
Myricatomentoside II,5TMS,isomer #5	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=C1OC	4170.3	Semi standard non polar	33892256
Myricatomentoside II,5TMS,isomer #6	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=C1OC	4171.1	Semi standard non polar	33892256
Myricatomentoside II,5TMS,isomer #7	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=C1OC	4183.7	Semi standard non polar	33892256
Myricatomentoside II,5TMS,isomer #8	COC1=C2C=C(CCCCC(O[Si](C)(C)C)=C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=C1OC	4171.9	Semi standard non polar	33892256
Myricatomentoside II,5TMS,isomer #9	COC1=C2C=C(CCCC=C(O[Si](C)(C)C)C(O)CC3=CC2=C(O[Si](C)(C)C)C=C3)C(OC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=C1OC	4188.2	Semi standard non polar	33892256
Myricatomentoside II,1TBDMS,isomer #1	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C(C)(C)C)C(O)C(O)C2O)=C1OC	4759.5	Semi standard non polar	33892256
Myricatomentoside II,1TBDMS,isomer #2	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)=C1OC	4749.7	Semi standard non polar	33892256
Myricatomentoside II,1TBDMS,isomer #3	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)=C1OC	4732.6	Semi standard non polar	33892256
Myricatomentoside II,1TBDMS,isomer #4	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)=C1OC	4755.8	Semi standard non polar	33892256
Myricatomentoside II,1TBDMS,isomer #5	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O[Si](C)(C)C(C)(C)C)C=C3)C(OC2OC(CO)C(O)C(O)C2O)=C1OC	4771.0	Semi standard non polar	33892256
Myricatomentoside II,1TBDMS,isomer #6	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C(C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O)C(O)C2O)=C1OC	4741.9	Semi standard non polar	33892256
Myricatomentoside II,1TBDMS,isomer #7	COC1=C2C=C(CCCCC(O[Si](C)(C)C(C)(C)C)=C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O)C(O)C2O)=C1OC	4717.4	Semi standard non polar	33892256
Myricatomentoside II,1TBDMS,isomer #8	COC1=C2C=C(CCCC=C(O[Si](C)(C)C(C)(C)C)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O)C(O)C2O)=C1OC	4761.2	Semi standard non polar	33892256
Myricatomentoside II,2TBDMS,isomer #1	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)=C1OC	4849.1	Semi standard non polar	33892256
Myricatomentoside II,2TBDMS,isomer #10	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C(C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)=C1OC	4822.1	Semi standard non polar	33892256
Myricatomentoside II,2TBDMS,isomer #11	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O[Si](C)(C)C(C)(C)C)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)=C1OC	4887.2	Semi standard non polar	33892256
Myricatomentoside II,2TBDMS,isomer #12	COC1=C2C=C(CCCCC(O[Si](C)(C)C(C)(C)C)=C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)=C1OC	4808.9	Semi standard non polar	33892256
Myricatomentoside II,2TBDMS,isomer #13	COC1=C2C=C(CCCC=C(O[Si](C)(C)C(C)(C)C)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)=C1OC	4834.3	Semi standard non polar	33892256
Myricatomentoside II,2TBDMS,isomer #14	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)=C1OC	4844.7	Semi standard non polar	33892256
Myricatomentoside II,2TBDMS,isomer #15	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C(C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)=C1OC	4788.9	Semi standard non polar	33892256
Myricatomentoside II,2TBDMS,isomer #16	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O[Si](C)(C)C(C)(C)C)C=C3)C(OC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)=C1OC	4841.7	Semi standard non polar	33892256
Myricatomentoside II,2TBDMS,isomer #17	COC1=C2C=C(CCCCC(O[Si](C)(C)C(C)(C)C)=C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)=C1OC	4779.9	Semi standard non polar	33892256
Myricatomentoside II,2TBDMS,isomer #18	COC1=C2C=C(CCCC=C(O[Si](C)(C)C(C)(C)C)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)=C1OC	4813.3	Semi standard non polar	33892256
Myricatomentoside II,2TBDMS,isomer #19	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C(C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)=C1OC	4822.7	Semi standard non polar	33892256
Myricatomentoside II,2TBDMS,isomer #2	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)=C1OC	4829.8	Semi standard non polar	33892256
Myricatomentoside II,2TBDMS,isomer #20	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O[Si](C)(C)C(C)(C)C)C=C3)C(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)=C1OC	4887.4	Semi standard non polar	33892256
Myricatomentoside II,2TBDMS,isomer #21	COC1=C2C=C(CCCCC(O[Si](C)(C)C(C)(C)C)=C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)=C1OC	4810.5	Semi standard non polar	33892256
Myricatomentoside II,2TBDMS,isomer #22	COC1=C2C=C(CCCC=C(O[Si](C)(C)C(C)(C)C)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)=C1OC	4839.4	Semi standard non polar	33892256
Myricatomentoside II,2TBDMS,isomer #23	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C(C)(C)C)CC3=CC2=C(O[Si](C)(C)C(C)(C)C)C=C3)C(OC2OC(CO)C(O)C(O)C2O)=C1OC	4867.0	Semi standard non polar	33892256
Myricatomentoside II,2TBDMS,isomer #24	COC1=C2C=C(CCCCC(O[Si](C)(C)C(C)(C)C)=C(O)CC3=CC2=C(O[Si](C)(C)C(C)(C)C)C=C3)C(OC2OC(CO)C(O)C(O)C2O)=C1OC	4847.8	Semi standard non polar	33892256
Myricatomentoside II,2TBDMS,isomer #25	COC1=C2C=C(CCCC=C(O[Si](C)(C)C(C)(C)C)C(O)CC3=CC2=C(O[Si](C)(C)C(C)(C)C)C=C3)C(OC2OC(CO)C(O)C(O)C2O)=C1OC	4892.3	Semi standard non polar	33892256
Myricatomentoside II,2TBDMS,isomer #26	COC1=C2C=C(CCCCC(O[Si](C)(C)C(C)(C)C)=C(O[Si](C)(C)C(C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O)C(O)C2O)=C1OC	4876.4	Semi standard non polar	33892256
Myricatomentoside II,2TBDMS,isomer #27	COC1=C2C=C(CCCC=C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O)C(O)C2O)=C1OC	4876.3	Semi standard non polar	33892256
Myricatomentoside II,2TBDMS,isomer #3	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C(C)(C)C)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)=C1OC	4864.3	Semi standard non polar	33892256
Myricatomentoside II,2TBDMS,isomer #4	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C(C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C(C)(C)C)C(O)C(O)C2O)=C1OC	4831.1	Semi standard non polar	33892256
Myricatomentoside II,2TBDMS,isomer #5	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O[Si](C)(C)C(C)(C)C)C=C3)C(OC2OC(CO[Si](C)(C)C(C)(C)C)C(O)C(O)C2O)=C1OC	4875.2	Semi standard non polar	33892256
Myricatomentoside II,2TBDMS,isomer #6	COC1=C2C=C(CCCCC(O[Si](C)(C)C(C)(C)C)=C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C(C)(C)C)C(O)C(O)C2O)=C1OC	4816.2	Semi standard non polar	33892256
Myricatomentoside II,2TBDMS,isomer #7	COC1=C2C=C(CCCC=C(O[Si](C)(C)C(C)(C)C)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C(C)(C)C)C(O)C(O)C2O)=C1OC	4839.2	Semi standard non polar	33892256
Myricatomentoside II,2TBDMS,isomer #8	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C2O)=C1OC	4833.6	Semi standard non polar	33892256
Myricatomentoside II,2TBDMS,isomer #9	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O[Si](C)(C)C(C)(C)C)=C1OC	4840.2	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #1	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C2O)=C1OC	4938.6	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #10	COC1=C2C=C(CCCCC(O[Si](C)(C)C(C)(C)C)=C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)=C1OC	4882.3	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #11	COC1=C2C=C(CCCC=C(O[Si](C)(C)C(C)(C)C)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)=C1OC	4887.6	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #12	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C(C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C(C)(C)C)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)=C1OC	4914.7	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #13	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O[Si](C)(C)C(C)(C)C)C=C3)C(OC2OC(CO[Si](C)(C)C(C)(C)C)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)=C1OC	4995.5	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #14	COC1=C2C=C(CCCCC(O[Si](C)(C)C(C)(C)C)=C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C(C)(C)C)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)=C1OC	4912.2	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #15	COC1=C2C=C(CCCC=C(O[Si](C)(C)C(C)(C)C)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C(C)(C)C)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)=C1OC	4915.0	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #16	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C(C)(C)C)CC3=CC2=C(O[Si](C)(C)C(C)(C)C)C=C3)C(OC2OC(CO[Si](C)(C)C(C)(C)C)C(O)C(O)C2O)=C1OC	4937.4	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #17	COC1=C2C=C(CCCCC(O[Si](C)(C)C(C)(C)C)=C(O[Si](C)(C)C(C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C(C)(C)C)C(O)C(O)C2O)=C1OC	4914.4	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #18	COC1=C2C=C(CCCC=C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C(C)(C)C)C(O)C(O)C2O)=C1OC	4912.7	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #19	COC1=C2C=C(CCCCC(O[Si](C)(C)C(C)(C)C)=C(O)CC3=CC2=C(O[Si](C)(C)C(C)(C)C)C=C3)C(OC2OC(CO[Si](C)(C)C(C)(C)C)C(O)C(O)C2O)=C1OC	4921.2	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #2	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)C2O[Si](C)(C)C(C)(C)C)=C1OC	4985.5	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #20	COC1=C2C=C(CCCC=C(O[Si](C)(C)C(C)(C)C)C(O)CC3=CC2=C(O[Si](C)(C)C(C)(C)C)C=C3)C(OC2OC(CO[Si](C)(C)C(C)(C)C)C(O)C(O)C2O)=C1OC	4950.6	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #21	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)=C1OC	4916.4	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #22	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C(C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C2O)=C1OC	4854.4	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #23	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O[Si](C)(C)C(C)(C)C)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C2O)=C1OC	4938.3	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #24	COC1=C2C=C(CCCCC(O[Si](C)(C)C(C)(C)C)=C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C2O)=C1OC	4868.2	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #25	COC1=C2C=C(CCCC=C(O[Si](C)(C)C(C)(C)C)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C2O)=C1OC	4870.4	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #26	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C(C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O[Si](C)(C)C(C)(C)C)=C1OC	4873.8	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #27	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O[Si](C)(C)C(C)(C)C)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O[Si](C)(C)C(C)(C)C)=C1OC	4961.0	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #28	COC1=C2C=C(CCCCC(O[Si](C)(C)C(C)(C)C)=C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O[Si](C)(C)C(C)(C)C)=C1OC	4873.5	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #29	COC1=C2C=C(CCCC=C(O[Si](C)(C)C(C)(C)C)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O[Si](C)(C)C(C)(C)C)=C1OC	4880.4	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #3	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C(C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)=C1OC	4900.9	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #30	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C(C)(C)C)CC3=CC2=C(O[Si](C)(C)C(C)(C)C)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)=C1OC	4930.2	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #31	COC1=C2C=C(CCCCC(O[Si](C)(C)C(C)(C)C)=C(O[Si](C)(C)C(C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)=C1OC	4902.8	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #32	COC1=C2C=C(CCCC=C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)=C1OC	4903.5	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #33	COC1=C2C=C(CCCCC(O[Si](C)(C)C(C)(C)C)=C(O)CC3=CC2=C(O[Si](C)(C)C(C)(C)C)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)=C1OC	4927.0	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #34	COC1=C2C=C(CCCC=C(O[Si](C)(C)C(C)(C)C)C(O)CC3=CC2=C(O[Si](C)(C)C(C)(C)C)C=C3)C(OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)=C1OC	4949.0	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #35	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C(C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)=C1OC	4873.5	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #36	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O[Si](C)(C)C(C)(C)C)C=C3)C(OC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)=C1OC	4956.6	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #37	COC1=C2C=C(CCCCC(O[Si](C)(C)C(C)(C)C)=C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)=C1OC	4879.7	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #38	COC1=C2C=C(CCCC=C(O[Si](C)(C)C(C)(C)C)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)=C1OC	4892.6	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #39	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C(C)(C)C)CC3=CC2=C(O[Si](C)(C)C(C)(C)C)C=C3)C(OC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)=C1OC	4891.8	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #4	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O[Si](C)(C)C(C)(C)C)C=C3)C(OC2OC(CO[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)=C1OC	4982.3	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #40	COC1=C2C=C(CCCCC(O[Si](C)(C)C(C)(C)C)=C(O[Si](C)(C)C(C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)=C1OC	4886.3	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #41	COC1=C2C=C(CCCC=C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)=C1OC	4869.9	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #42	COC1=C2C=C(CCCCC(O[Si](C)(C)C(C)(C)C)=C(O)CC3=CC2=C(O[Si](C)(C)C(C)(C)C)C=C3)C(OC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)=C1OC	4892.9	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #43	COC1=C2C=C(CCCC=C(O[Si](C)(C)C(C)(C)C)C(O)CC3=CC2=C(O[Si](C)(C)C(C)(C)C)C=C3)C(OC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)=C1OC	4913.6	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #44	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C(C)(C)C)CC3=CC2=C(O[Si](C)(C)C(C)(C)C)C=C3)C(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)=C1OC	4929.4	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #45	COC1=C2C=C(CCCCC(O[Si](C)(C)C(C)(C)C)=C(O[Si](C)(C)C(C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)=C1OC	4903.1	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #46	COC1=C2C=C(CCCC=C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)=C1OC	4901.1	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #47	COC1=C2C=C(CCCCC(O[Si](C)(C)C(C)(C)C)=C(O)CC3=CC2=C(O[Si](C)(C)C(C)(C)C)C=C3)C(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)=C1OC	4918.6	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #48	COC1=C2C=C(CCCC=C(O[Si](C)(C)C(C)(C)C)C(O)CC3=CC2=C(O[Si](C)(C)C(C)(C)C)C=C3)C(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)=C1OC	4943.1	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #49	COC1=C2C=C(CCCCC(O[Si](C)(C)C(C)(C)C)=C(O[Si](C)(C)C(C)(C)C)CC3=CC2=C(O[Si](C)(C)C(C)(C)C)C=C3)C(OC2OC(CO)C(O)C(O)C2O)=C1OC	4958.3	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #5	COC1=C2C=C(CCCCC(O[Si](C)(C)C(C)(C)C)=C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)=C1OC	4901.6	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #50	COC1=C2C=C(CCCC=C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)CC3=CC2=C(O[Si](C)(C)C(C)(C)C)C=C3)C(OC2OC(CO)C(O)C(O)C2O)=C1OC	4967.6	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #6	COC1=C2C=C(CCCC=C(O[Si](C)(C)C(C)(C)C)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)=C1OC	4901.6	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #7	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)=C1OC	4949.4	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #8	COC1=C2C=C(CCCCC(=O)C(O[Si](C)(C)C(C)(C)C)CC3=CC2=C(O)C=C3)C(OC2OC(CO[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)=C1OC	4872.8	Semi standard non polar	33892256
Myricatomentoside II,3TBDMS,isomer #9	COC1=C2C=C(CCCCC(=O)C(O)CC3=CC2=C(O[Si](C)(C)C(C)(C)C)C=C3)C(OC2OC(CO[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)=C1OC	4959.8	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 - Myricatomentoside II GC-MS (Non-derivatized) - 70eV, Positive	splash10-0600-9301360000-beffb56c1d1064b38dd9	2017-09-01	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Myricatomentoside II GC-MS (2 TMS) - 70eV, Positive	splash10-03di-4332029000-d64fa5475b368988e095	2017-10-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Myricatomentoside II GC-MS (TMS_1_1) - 70eV, Positive	Not Available	2021-10-13	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Myricatomentoside II GC-MS (TMS_1_2) - 70eV, Positive	Not Available	2021-10-13	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Myricatomentoside II GC-MS (TMS_1_3) - 70eV, Positive	Not Available	2021-10-13	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Myricatomentoside II GC-MS (TMS_1_4) - 70eV, Positive	Not Available	2021-10-13	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Myricatomentoside II GC-MS (TMS_1_5) - 70eV, Positive	Not Available	2021-10-13	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Myricatomentoside II GC-MS (TMS_1_6) - 70eV, Positive	Not Available	2021-10-13	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Myricatomentoside II GC-MS (TMS_1_7) - 70eV, Positive	Not Available	2021-10-13	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Myricatomentoside II GC-MS (TMS_1_8) - 70eV, Positive	Not Available	2021-10-13	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Myricatomentoside II GC-MS (TMS_2_2) - 70eV, Positive	Not Available	2021-10-13	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Myricatomentoside II GC-MS (TMS_2_3) - 70eV, Positive	Not Available	2021-10-13	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Myricatomentoside II GC-MS (TMS_2_4) - 70eV, Positive	Not Available	2021-10-13	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Myricatomentoside II GC-MS (TMS_2_5) - 70eV, Positive	Not Available	2021-10-13	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Myricatomentoside II GC-MS (TMS_2_6) - 70eV, Positive	Not Available	2021-10-13	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Myricatomentoside II GC-MS (TMS_2_7) - 70eV, Positive	Not Available	2021-10-13	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Myricatomentoside II GC-MS (TMS_2_8) - 70eV, Positive	Not Available	2021-10-13	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Myricatomentoside II GC-MS (TMS_2_9) - 70eV, Positive	Not Available	2021-10-13	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Myricatomentoside II GC-MS (TMS_2_10) - 70eV, Positive	Not Available	2021-10-13	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Myricatomentoside II GC-MS (TMS_2_11) - 70eV, Positive	Not Available	2021-10-13	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Myricatomentoside II GC-MS (TMS_2_12) - 70eV, Positive	Not Available	2021-10-13	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Myricatomentoside II GC-MS (TMS_2_13) - 70eV, Positive	Not Available	2021-10-13	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Myricatomentoside II GC-MS (TMS_2_14) - 70eV, Positive	Not Available	2021-10-13	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Myricatomentoside II GC-MS (TMS_2_15) - 70eV, Positive	Not Available	2021-10-13	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Myricatomentoside II GC-MS (TMS_2_16) - 70eV, Positive	Not Available	2021-10-13	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 - Myricatomentoside II 10V, Positive-QTOF	splash10-0609-0109060000-577f28711909f78e4779	2015-04-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Myricatomentoside II 20V, Positive-QTOF	splash10-05fr-1009000000-c037c26a02d5d78e1936	2015-04-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Myricatomentoside II 40V, Positive-QTOF	splash10-0ab9-2149000000-dc625c0212972220a10d	2015-04-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Myricatomentoside II 10V, Negative-QTOF	splash10-0089-1305090000-cde2f084d437a26ec4fa	2015-04-25	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Myricatomentoside II 20V, Negative-QTOF	splash10-05fr-1109020000-6ba163decd4d17841740	2015-04-25	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Myricatomentoside II 40V, Negative-QTOF	splash10-0ab9-2029000000-191c26ccf976f104b3aa	2015-04-25	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Myricatomentoside II 10V, Negative-QTOF	splash10-001i-0001090000-418df505c3597600c579	2021-09-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Myricatomentoside II 20V, Negative-QTOF	splash10-07wa-1304590000-89a5944643b440cde2c6	2021-09-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Myricatomentoside II 40V, Negative-QTOF	splash10-0pb9-1009100000-c6cea146419e5dd6547c	2021-09-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Myricatomentoside II 10V, Positive-QTOF	splash10-0a4i-0009010000-4dbbb1543c5a9e36c12a	2021-09-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Myricatomentoside II 20V, Positive-QTOF	splash10-052b-0204930000-e43cec2660b74ee1e081	2021-09-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Myricatomentoside II 40V, Positive-QTOF	splash10-0a4s-4209100000-c7bc67682576c9dfe57e	2021-09-24	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

FDB008210

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

85277603

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

Myricatomentoside II → (3-hydroxy-16,17-dimethoxy-9-oxo-15-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}tricyclo[12.3.1.1²,⁶]nonadeca-1(17),2,4,6(19),14(18),15-hexaen-8-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

Myricatomentoside II → 3,4,5-trihydroxy-6-[(8-hydroxy-16,17-dimethoxy-9-oxo-15-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}tricyclo[12.3.1.1²,⁶]nonadeca-1(17),2,4,6(19),14(18),15-hexaen-3-yl)oxy]oxane-2-carboxylic acid	details

Showing metabocard for Myricatomentoside II (HMDB0031584)

MOL for HMDB0031584 (Myricatomentoside II)

3D MOL for HMDB0031584 (Myricatomentoside II)

3D SDF for HMDB0031584 (Myricatomentoside II)

3D-SDF for HMDB0031584 (Myricatomentoside II)

PDB for HMDB0031584 (Myricatomentoside II)

3D PDB for HMDB0031584 (Myricatomentoside II)

SMILES for HMDB0031584 (Myricatomentoside II)

INCHI for HMDB0031584 (Myricatomentoside II)

Structure for HMDB0031584 (Myricatomentoside II)

3D Structure for HMDB0031584 (Myricatomentoside II)

Predicted Collision Cross Sections

Predicted Kovats Retention Indices

Underivatized

Derivatized

GC-MS Spectra

MS/MS Spectra

Enzymes

Reactions

Reactions