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Identification Taxonomy Ontology Physical properties Spectra Biological properties Concentrations Links References enzymes (21) Show 21 proteins XML

Record Information

Version

5.0

Status

Expected but not Quantified

Creation Date

2006-08-13 08:16:58 UTC

Update Date

2021-09-14 15:44:39 UTC

HMDB ID

HMDB0003971

Secondary Accession Numbers

HMDB03971

Metabolite Identification

Common Name

Beta-D-Fructose 6-phosphate

Description

Beta-D-Fructose 6 phosphate (b-F6P) is the beta-anomer of fructose-6-phosphate. There are two anomers of fructose 6 phosphate, the alpha anomer and the beta anomer. Specifically, beta-D-fructose 6-phosphate is fructose sugar phosphorylated on carbon 6. Beta-D-Fructose 6-phosphate is a substrate for Fructose-1,6-bisphosphatase, Pyruvate kinase (isozymes R/L), Hexokinase (type I), Fructose-bisphosphate aldolase A, L-lactate dehydrogenase B chain, Glyceraldehyde-3-phosphate dehydrogenase (liver) and Transaldolase.

Structure

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

HMDB0003971
     RDKit          3D
Beta-D-Fructose 6-phosphate
 29 29  0  0  0  0  0  0  0  0999 V2000
    4.2740   -0.9476   -1.3017 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8597   -0.3500    0.0237 P   0  0  0  0  0  5  0  0  0  0  0  0
    5.0688    0.7234    0.5509 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6940   -1.5646    1.1898 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4244    0.4987   -0.1675 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3946   -0.3611   -0.5393 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1089    0.4276   -0.7061 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.9504   -0.3628   -1.0735 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9372   -0.2699   -0.1309 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.6224   -1.1261    0.9229 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3107   -0.5631   -0.6542 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2901   -1.8736   -1.1488 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7963    1.1424    0.3967 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.4372    1.3249    1.6083 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2707    1.1291    0.5800 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.2504    2.3812    0.7058 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4645    1.1735   -0.2517 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4528   -2.3987    0.7071 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2761   -1.1221    0.2570 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6830   -0.8322   -1.4793 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2620    1.2106   -1.4774 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2025   -1.9650    0.6007 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0963   -0.5141    0.0946 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5616    0.0830   -1.5200 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9998   -2.4306   -0.7517 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0166    1.9115   -0.3539 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3302    1.7300    1.4173 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0500    0.4523    1.4367 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6588    2.4933    1.6219 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  2  4  1  0
  2  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  1
  9 11  1  0
 11 12  1  0
  9 13  1  0
 13 14  1  0
 13 15  1  0
 15 16  1  0
 15  7  1  0
  3 17  1  0
  4 18  1  0
  6 19  1  0
  6 20  1  0
  7 21  1  6
 10 22  1  0
 11 23  1  0
 11 24  1  0
 12 25  1  0
 13 26  1  6
 14 27  1  0
 15 28  1  1
 16 29  1  0
M  END


  Mrv1652309042000302D          

 16 16  0  0  1  0            999 V2000
   25.4547  -12.4935    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   24.9698  -11.8260    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   26.1221  -12.0085    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   25.9397  -13.1609    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   24.5573   -9.3940    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   22.7669   -9.3078    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.7998  -10.2052    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   22.3544  -11.9122    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   23.9193  -10.4602    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   24.7873  -12.9784    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   23.7368   -9.3078    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.1493  -11.9122    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.2519   -9.9752    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   23.6644  -11.2448    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   22.5844  -10.4602    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   22.8394  -11.2448    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  1 10  2  0  0  0  0
  2 12  1  0  0  0  0
  5 11  1  0  0  0  0
 13  6  1  6  0  0  0
 15  7  1  6  0  0  0
 16  8  1  1  0  0  0
  9 13  1  0  0  0  0
  9 14  1  0  0  0  0
 13 11  1  1  0  0  0
 14 12  1  6  0  0  0
 13 15  1  0  0  0  0
 14 16  1  0  0  0  0
 15 16  1  0  0  0  0
M  END
> <DATABASE_ID>
HMDB0003971

> <DATABASE_NAME>
hmdb

> <SMILES>
OC[C@@]1(O)O[C@H](COP(O)(O)=O)[C@@H](O)[C@@H]1O

> <INCHI_IDENTIFIER>
InChI=1S/C6H13O9P/c7-2-6(10)5(9)4(8)3(15-6)1-14-16(11,12)13/h3-5,7-10H,1-2H2,(H2,11,12,13)/t3-,4-,5+,6-/m1/s1

> <INCHI_KEY>
BGWGXPAPYGQALX-ARQDHWQXSA-N

> <FORMULA>
C6H13O9P

> <MOLECULAR_WEIGHT>
260.1358

> <EXACT_MASS>
260.029718526

> <JCHEM_ACCEPTOR_COUNT>
8

> <JCHEM_ATOM_COUNT>
29

> <JCHEM_AVERAGE_POLARIZABILITY>
20.920194475195775

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
6

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
{[(2R,3S,4S,5R)-3,4,5-trihydroxy-5-(hydroxymethyl)oxolan-2-yl]methoxy}phosphonic acid

> <ALOGPS_LOGP>
-2.11

> <JCHEM_LOGP>
-2.881565349333333

> <ALOGPS_LOGS>
-0.89

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
1

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-2

> <JCHEM_PKA>
6.247455552280457

> <JCHEM_PKA_STRONGEST_ACIDIC>
1.221675286190254

> <JCHEM_PKA_STRONGEST_BASIC>
-3.450967575782875

> <JCHEM_POLAR_SURFACE_AREA>
156.91

> <JCHEM_REFRACTIVITY>
47.2337

> <JCHEM_ROTATABLE_BOND_COUNT>
4

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
3.34e+01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
β-D-fructofuranose 6-phosphate

> <JCHEM_VEBER_RULE>
0

$$$$

HMDB0003971
     RDKit          3D
Beta-D-Fructose 6-phosphate
 29 29  0  0  0  0  0  0  0  0999 V2000
    4.2740   -0.9476   -1.3017 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8597   -0.3500    0.0237 P   0  0  0  0  0  5  0  0  0  0  0  0
    5.0688    0.7234    0.5509 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6940   -1.5646    1.1898 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4244    0.4987   -0.1675 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3946   -0.3611   -0.5393 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1089    0.4276   -0.7061 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.9504   -0.3628   -1.0735 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9372   -0.2699   -0.1309 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.6224   -1.1261    0.9229 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3107   -0.5631   -0.6542 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2901   -1.8736   -1.1488 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7963    1.1424    0.3967 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.4372    1.3249    1.6083 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2707    1.1291    0.5800 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.2504    2.3812    0.7058 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4645    1.1735   -0.2517 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4528   -2.3987    0.7071 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2761   -1.1221    0.2570 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6830   -0.8322   -1.4793 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2620    1.2106   -1.4774 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2025   -1.9650    0.6007 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0963   -0.5141    0.0946 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5616    0.0830   -1.5200 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9998   -2.4306   -0.7517 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0166    1.9115   -0.3539 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3302    1.7300    1.4173 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0500    0.4523    1.4367 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6588    2.4933    1.6219 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  2  4  1  0
  2  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  1
  9 11  1  0
 11 12  1  0
  9 13  1  0
 13 14  1  0
 13 15  1  0
 15 16  1  0
 15  7  1  0
  3 17  1  0
  4 18  1  0
  6 19  1  0
  6 20  1  0
  7 21  1  6
 10 22  1  0
 11 23  1  0
 11 24  1  0
 12 25  1  0
 13 26  1  6
 14 27  1  0
 15 28  1  1
 16 29  1  0
M  END

HEADER    PROTEIN                                 04-SEP-20   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   04-SEP-20         0                                  
HETATM    1  P   UNK     0      47.515 -23.321   0.000  0.00  0.00           P+0
HETATM    2  O   UNK     0      46.610 -22.075   0.000  0.00  0.00           O+0
HETATM    3  O   UNK     0      48.761 -22.416   0.000  0.00  0.00           O+0
HETATM    4  O   UNK     0      48.421 -24.567   0.000  0.00  0.00           O+0
HETATM    5  O   UNK     0      45.840 -17.535   0.000  0.00  0.00           O+0
HETATM    6  O   UNK     0      42.498 -17.375   0.000  0.00  0.00           O+0
HETATM    7  O   UNK     0      40.693 -19.050   0.000  0.00  0.00           O+0
HETATM    8  O   UNK     0      41.728 -22.236   0.000  0.00  0.00           O+0
HETATM    9  O   UNK     0      44.649 -19.526   0.000  0.00  0.00           O+0
HETATM   10  O   UNK     0      46.270 -24.226   0.000  0.00  0.00           O+0
HETATM   11  C   UNK     0      44.309 -17.375   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      45.079 -22.236   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      43.404 -18.620   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      44.174 -20.990   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0      42.158 -19.526   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0      42.634 -20.990   0.000  0.00  0.00           C+0
CONECT    1    2    3    4   10                                             
CONECT    2    1   12                                                       
CONECT    3    1                                                            
CONECT    4    1                                                            
CONECT    5   11                                                            
CONECT    6   13                                                            
CONECT    7   15                                                            
CONECT    8   16                                                            
CONECT    9   13   14                                                       
CONECT   10    1                                                            
CONECT   11    5   13                                                       
CONECT   12    2   14                                                       
CONECT   13    6    9   11   15                                             
CONECT   14    9   12   16                                                  
CONECT   15    7   13   16                                                  
CONECT   16    8   14   15                                                  
MASTER        0    0    0    0    0    0    0    0   16    0   32    0
END

COMPND    HMDB0003971
HETATM    1  O1  UNL     1       4.274  -0.948  -1.302  1.00  0.00           O  
HETATM    2  P1  UNL     1       3.860  -0.350   0.024  1.00  0.00           P  
HETATM    3  O2  UNL     1       5.069   0.723   0.551  1.00  0.00           O  
HETATM    4  O3  UNL     1       3.694  -1.565   1.190  1.00  0.00           O  
HETATM    5  O4  UNL     1       2.424   0.499  -0.168  1.00  0.00           O  
HETATM    6  C1  UNL     1       1.395  -0.361  -0.539  1.00  0.00           C  
HETATM    7  C2  UNL     1       0.109   0.428  -0.706  1.00  0.00           C  
HETATM    8  O5  UNL     1      -0.950  -0.363  -1.073  1.00  0.00           O  
HETATM    9  C3  UNL     1      -1.937  -0.270  -0.131  1.00  0.00           C  
HETATM   10  O6  UNL     1      -1.622  -1.126   0.923  1.00  0.00           O  
HETATM   11  C4  UNL     1      -3.311  -0.563  -0.654  1.00  0.00           C  
HETATM   12  O7  UNL     1      -3.290  -1.874  -1.149  1.00  0.00           O  
HETATM   13  C5  UNL     1      -1.796   1.142   0.397  1.00  0.00           C  
HETATM   14  O8  UNL     1      -2.437   1.325   1.608  1.00  0.00           O  
HETATM   15  C6  UNL     1      -0.271   1.129   0.580  1.00  0.00           C  
HETATM   16  O9  UNL     1       0.250   2.381   0.706  1.00  0.00           O  
HETATM   17  H1  UNL     1       5.465   1.174  -0.252  1.00  0.00           H  
HETATM   18  H2  UNL     1       3.453  -2.399   0.707  1.00  0.00           H  
HETATM   19  H3  UNL     1       1.276  -1.122   0.257  1.00  0.00           H  
HETATM   20  H4  UNL     1       1.683  -0.832  -1.479  1.00  0.00           H  
HETATM   21  H5  UNL     1       0.262   1.211  -1.477  1.00  0.00           H  
HETATM   22  H6  UNL     1      -1.202  -1.965   0.601  1.00  0.00           H  
HETATM   23  H7  UNL     1      -4.096  -0.514   0.095  1.00  0.00           H  
HETATM   24  H8  UNL     1      -3.562   0.083  -1.520  1.00  0.00           H  
HETATM   25  H9  UNL     1      -4.000  -2.431  -0.752  1.00  0.00           H  
HETATM   26  H10 UNL     1      -2.017   1.911  -0.354  1.00  0.00           H  
HETATM   27  H11 UNL     1      -3.330   1.730   1.417  1.00  0.00           H  
HETATM   28  H12 UNL     1      -0.050   0.452   1.437  1.00  0.00           H  
HETATM   29  H13 UNL     1       0.659   2.493   1.622  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3    4    5
CONECT    3   17
CONECT    4   18
CONECT    5    6
CONECT    6    7   19   20
CONECT    7    8   15   21
CONECT    8    9
CONECT    9   10   11   13
CONECT   10   22
CONECT   11   12   23   24
CONECT   12   25
CONECT   13   14   15   26
CONECT   14   27
CONECT   15   16   28
CONECT   16   29
END

HMDB0003971
     RDKit          3D
Beta-D-Fructose 6-phosphate
 29 29  0  0  0  0  0  0  0  0999 V2000
    4.2740   -0.9476   -1.3017 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8597   -0.3500    0.0237 P   0  0  0  0  0  5  0  0  0  0  0  0
    5.0688    0.7234    0.5509 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6940   -1.5646    1.1898 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4244    0.4987   -0.1675 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3946   -0.3611   -0.5393 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1089    0.4276   -0.7061 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.9504   -0.3628   -1.0735 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9372   -0.2699   -0.1309 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.6224   -1.1261    0.9229 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3107   -0.5631   -0.6542 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2901   -1.8736   -1.1488 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7963    1.1424    0.3967 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.4372    1.3249    1.6083 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2707    1.1291    0.5800 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.2504    2.3812    0.7058 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4645    1.1735   -0.2517 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4528   -2.3987    0.7071 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2761   -1.1221    0.2570 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6830   -0.8322   -1.4793 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2620    1.2106   -1.4774 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2025   -1.9650    0.6007 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0963   -0.5141    0.0946 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5616    0.0830   -1.5200 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9998   -2.4306   -0.7517 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0166    1.9115   -0.3539 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3302    1.7300    1.4173 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0500    0.4523    1.4367 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6588    2.4933    1.6219 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  2  4  1  0
  2  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  1
  9 11  1  0
 11 12  1  0
  9 13  1  0
 13 14  1  0
 13 15  1  0
 15 16  1  0
 15  7  1  0
  3 17  1  0
  4 18  1  0
  6 19  1  0
  6 20  1  0
  7 21  1  6
 10 22  1  0
 11 23  1  0
 11 24  1  0
 12 25  1  0
 13 26  1  6
 14 27  1  0
 15 28  1  1
 16 29  1  0
M  END

View in JSmol View NMR Assignments View Stereo Labels

Synonyms

Value	Source
6-O-Phosphono-beta-D-fructofuranose	ChEBI
FRUCTOSE-6-phosphATE	ChEBI
6-O-Phosphono-b-D-fructofuranose	Generator
6-O-Phosphono-β-D-fructofuranose	Generator
FRUCTOSE-6-phosphoric acid	Generator
b-D-Fructose 6-phosphate	Generator
b-D-Fructose 6-phosphoric acid	Generator
beta-D-Fructose 6-phosphoric acid	Generator
Β-D-fructose 6-phosphate	Generator
Β-D-fructose 6-phosphoric acid	Generator

Chemical Formula

C₆H₁₃O₉P

Average Molecular Weight

260.1358

Monoisotopic Molecular Weight

260.029718526

IUPAC Name

{[(2R,3S,4S,5R)-3,4,5-trihydroxy-5-(hydroxymethyl)oxolan-2-yl]methoxy}phosphonic acid

Traditional Name

β-D-fructofuranose 6-phosphate

CAS Registry Number

Not Available

SMILES

OC[C@@]1(O)O[C@H](COP(O)(O)=O)[C@@H](O)[C@@H]1O

InChI Identifier

InChI=1S/C6H13O9P/c7-2-6(10)5(9)4(8)3(15-6)1-14-16(11,12)13/h3-5,7-10H,1-2H2,(H2,11,12,13)/t3-,4-,5+,6-/m1/s1

InChI Key

BGWGXPAPYGQALX-ARQDHWQXSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as pentose phosphates. These are carbohydrate derivatives containing a pentose substituted by one or more phosphate groups.

Kingdom

Organic compounds

Super Class

Organic oxygen compounds

Class

Organooxygen compounds

Sub Class

Carbohydrates and carbohydrate conjugates

Direct Parent

Pentose phosphates

Alternative Parents

Substituents

Pentose phosphate
Pentose-5-phosphate
C-glycosyl compound
Glycosyl compound
Monosaccharide phosphate
Monoalkyl phosphate
Phosphoric acid ester
Organic phosphoric acid derivative
Alkyl phosphate
Tetrahydrofuran
Secondary alcohol
Hemiacetal
Polyol
Organoheterocyclic compound
Oxacycle
Primary alcohol
Alcohol
Hydrocarbon derivative
Organic oxide
Aliphatic heteromonocyclic compound

Molecular Framework

Aliphatic heteromonocyclic compounds

External Descriptors

D-fructofuranose 6-phosphate (CHEBI:16084 )

Ontology

Not Available

Prostate (HMDB: HMDB0003971)

Cellular substructure

Cytoplasm (HMDB: HMDB0003971)

Source

Endogenous

Endogenous (HMDB: HMDB0003971)

Greylag goose (FooDB: FOOD00368)
Guinea hen (FooDB: FOOD00373)
Ostrich (FooDB: FOOD00422)
Velvet duck (FooDB: FOOD00427)
Pheasant (FooDB: FOOD00430)
Squab (FooDB: FOOD00481)
Turkey (FooDB: FOOD00494)
Quail (FooDB: FOOD00541)
Anatidae (FooDB: FOOD00576)
Rock ptarmigan (FooDB: FOOD00597)
Columbidae (Dove, Pigeon) (FooDB: FOOD00610)
Chicken (FooDB: FOOD00329)
Mallard duck (FooDB: FOOD00353)
Emu (FooDB: FOOD00360)

Equine

Horse (FooDB: FOOD00378)

Lagomorph

Ovis

Sheep (Mutton, Lamb) (FooDB: FOOD00473)

Bovine

Venison

Deer (FooDB: FOOD00524)
Mule deer (FooDB: FOOD00348)
Elk (FooDB: FOOD00359)

Caprae

Domestic goat (FooDB: FOOD00529)

Swine

Domestic pig (FooDB: FOOD00536)
Wild boar (FooDB: FOOD00307)

Herb and spice mixture

Curry powder (FooDB: FOOD00678)

Vegetable

Cabbage

Onion-family vegetable

Root vegetable

Shoot vegetable

Leaf vegetable

Common beet (FooDB: FOOD00025)
Endive (FooDB: FOOD00048)
Rocket salad (ssp.) (FooDB: FOOD00077)
Swamp cabbage (FooDB: FOOD00091)
Lettuce (FooDB: FOOD00095)
Garden cress (FooDB: FOOD00099)
Spinach (FooDB: FOOD00178)
Swiss chard (FooDB: FOOD00237)
Chicory leaves (FooDB: FOOD00250)
Garland chrysanthemum (FooDB: FOOD00333)
Corn salad (FooDB: FOOD00340)
Jute (FooDB: FOOD00389)
Lambsquarters (FooDB: FOOD00394)
Malabar spinach (FooDB: FOOD00404)
New Zealand spinach (FooDB: FOOD00415)
Yautia (FooDB: FOOD00510)
Ostrich fern (FooDB: FOOD00556)
Romaine lettuce (FooDB: FOOD00888)
Iceberg lettuce (FooDB: FOOD00973)
Pea shoots (FooDB: FOOD00975)
Yau choy (FooDB: FOOD00976)
Water spinach (FooDB: FOOD00977)

Fruit vegetable

Pepper (FooDB: FOOD00040)
Olive (FooDB: FOOD00121)
Avocado (FooDB: FOOD00130)
Garden tomato (FooDB: FOOD00171)
Cherry tomato (FooDB: FOOD00172)
Garden tomato (var.) (FooDB: FOOD00173)
Eggplant (FooDB: FOOD00174)
Pepper (C. baccatum) (FooDB: FOOD00231)
Pepper (C. chinense) (FooDB: FOOD00232)
Pepper (Capsicum) (FooDB: FOOD00233)
Groundcherry (FooDB: FOOD00371)
Pepper (C. frutescens) (FooDB: FOOD00428)
Mexican groundcherry (FooDB: FOOD00491)
Pepper (C. pubescens) (FooDB: FOOD00849)
Green bell pepper (FooDB: FOOD00877)
Yellow bell pepper (FooDB: FOOD00878)
Orange bell pepper (FooDB: FOOD00879)
Red bell pepper (FooDB: FOOD00880)
Italian sweet red pepper (FooDB: FOOD00881)
Jalapeno pepper (FooDB: FOOD00955)
Cubanelle pepper (FooDB: FOOD00971)

Tuber

Stalk vegetable

Other vegetable

Giant butterbur (FooDB: FOOD00314)
Carob (FooDB: FOOD00321)
Chinese water chestnut (FooDB: FOOD00332)
Horseradish tree (FooDB: FOOD00379)
Sacred lotus (FooDB: FOOD00402)
Nopal (FooDB: FOOD00416)
Okra (FooDB: FOOD00420)
Sesbania flower (FooDB: FOOD00469)
Agave (FooDB: FOOD00563)
Narrowleaf cattail (FooDB: FOOD00564)
Heart of palm (FooDB: FOOD00718)
Tree fern (FooDB: FOOD00797)

Mushroom

Castanospermum australe (FooDB: FOOD00893)
Gentiana lutea (FooDB: FOOD00894)
Juniperus communis (FooDB: FOOD00895)
Albizia gummifera (FooDB: FOOD00896)

Fruit

Tropical fruit

Citrus

Lime (FooDB: FOOD00053)
Lemon (FooDB: FOOD00054)
Pummelo (FooDB: FOOD00055)
Mandarin orange (Clementine, Tangerine) (FooDB: FOOD00056)
Sweet orange (FooDB: FOOD00057)
Grapefruit/Pummelo hybrid (FooDB: FOOD00255)
Grapefruit (FooDB: FOOD00256)
Persian lime (FooDB: FOOD00543)
Sour orange (FooDB: FOOD00918)
Mikan (FooDB: FOOD00932)
Clementine (FooDB: FOOD00959)

Pome

Berry

Black crowberry (FooDB: FOOD00075)
Strawberry (FooDB: FOOD00083)
Black huckleberry (FooDB: FOOD00084)
Sea-buckthornberry (FooDB: FOOD00087)
Mulberry (FooDB: FOOD00116)
Black mulberry (FooDB: FOOD00117)
Black chokeberry (FooDB: FOOD00136)
Blackcurrant (FooDB: FOOD00155)
Redcurrant (FooDB: FOOD00156)
Gooseberry (FooDB: FOOD00157)
Cloudberry (FooDB: FOOD00161)
Red raspberry (FooDB: FOOD00162)
Black raspberry (FooDB: FOOD00163)
Black elderberry (FooDB: FOOD00166)
Rowanberry (FooDB: FOOD00176)
Vaccinium (Blueberry, Cranberry, Huckleberry) (FooDB: FOOD00188)
Lowbush blueberry (FooDB: FOOD00189)
Sparkleberry (FooDB: FOOD00190)
Highbush blueberry (FooDB: FOOD00191)
American cranberry (FooDB: FOOD00192)
Bilberry (FooDB: FOOD00193)
Lingonberry (FooDB: FOOD00194)
Muscadine grape (FooDB: FOOD00203)
Common grape (FooDB: FOOD00204)
Arctic blackberry (FooDB: FOOD00207)
Bayberry (FooDB: FOOD00209)
Elliott's blueberry (FooDB: FOOD00210)
Canada blueberry (FooDB: FOOD00211)
Bog bilberry (FooDB: FOOD00212)
Buffalo currant (FooDB: FOOD00213)
European cranberry (FooDB: FOOD00217)
Deerberry (FooDB: FOOD00218)
Cascade huckleberry (FooDB: FOOD00220)
Oval-leaf huckleberry (FooDB: FOOD00221)
Evergreen huckleberry (FooDB: FOOD00222)
Red huckleberry (FooDB: FOOD00223)
Summer grape (FooDB: FOOD00227)
Fox grape (FooDB: FOOD00228)
Half-highbush blueberry (FooDB: FOOD00248)
Jostaberry (FooDB: FOOD00257)
Sweet rowanberry (FooDB: FOOD00265)
Skunk currant (FooDB: FOOD00267)
Squashberry (FooDB: FOOD00344)
Elderberry (FooDB: FOOD00358)
Grape (FooDB: FOOD00369)
Alaska blueberry (FooDB: FOOD00380)
Loganberry (FooDB: FOOD00400)
Ohelo berry (FooDB: FOOD00419)
Salmonberry (FooDB: FOOD00456)
Strawberry guava (FooDB: FOOD00482)
Boysenberry (FooDB: FOOD00542)
Chinese bayberry (FooDB: FOOD00852)
Saskatoon berry (FooDB: FOOD00884)
Nanking cherry (FooDB: FOOD00885)
Rabbiteye blueberry (FooDB: FOOD00898)
Blackberry (FooDB: FOOD00906)
Partridge berry (FooDB: FOOD00931)
Green grape (FooDB: FOOD00964)
Red grape (FooDB: FOOD00965)
Black plum (FooDB: FOOD00966)
Black raisin (FooDB: FOOD00968)
Chinese plum (FooDB: FOOD00978)
Green plum (FooDB: FOOD00979)
Wampee (FooDB: FOOD00980)
Goji (FooDB: FOOD00982)
Monk fruit (FooDB: FOOD00983)
Hawthorn (FooDB: FOOD00985)
Lantern fruit (FooDB: FOOD00986)
Cape gooseberry (FooDB: FOOD00988)

Other fruit

Fig (FooDB: FOOD00081)
Date (FooDB: FOOD00135)
Jujube (FooDB: FOOD00388)

Drupe

Prunus (Cherry, Plum) (FooDB: FOOD00143)
Apricot (FooDB: FOOD00144)
Sweet cherry (FooDB: FOOD00145)
Sour cherry (FooDB: FOOD00146)
European plum (FooDB: FOOD00147)
Peach (FooDB: FOOD00149)
Nectarine (FooDB: FOOD00229)
Peach (var.) (FooDB: FOOD00230)
Common chokecherry (FooDB: FOOD00562)

Nut

Cashew nut (FooDB: FOOD00011)
Peanut (FooDB: FOOD00016)
Brazil nut (FooDB: FOOD00024)
Pecan nut (FooDB: FOOD00044)
Chestnut (FooDB: FOOD00045)
Common hazelnut (FooDB: FOOD00062)
Black walnut (FooDB: FOOD00093)
Common walnut (FooDB: FOOD00094)
Pine nut (FooDB: FOOD00138)
Pistachio (FooDB: FOOD00140)
Almond (FooDB: FOOD00148)
Macadamia nut (M. tetraphylla) (FooDB: FOOD00225)
Japanese walnut (FooDB: FOOD00240)
Acorn (FooDB: FOOD00282)
Beech nut (FooDB: FOOD00299)
Butternut (FooDB: FOOD00316)
Chinese chestnut (FooDB: FOOD00331)
European chestnut (FooDB: FOOD00363)
Hazelnut (FooDB: FOOD00376)
Hickory nut (FooDB: FOOD00377)
Japanese chestnut (FooDB: FOOD00385)
Pili nut (FooDB: FOOD00432)
Colorado pinyon (FooDB: FOOD00433)
Macadamia nut (FooDB: FOOD00525)
Walnut (FooDB: FOOD00608)

Cereal and cereal product

Cereal

Cereal product

Pasta (FooDB: FOOD00273)
Bulgur (FooDB: FOOD00741)
Semolina (FooDB: FOOD00745)
Flour (FooDB: FOOD00799)

Dough

Sourdough (FooDB: FOOD00275)

Leavened bread

Flat bread

Other bread

Potato bread (FooDB: FOOD00811)

Sweet bread

Raisin bread (FooDB: FOOD00817)

Pulse

Pea

Lentil

Lentils (FooDB: FOOD00098)

Other pulse

Lupine (FooDB: FOOD00104)
White lupine (FooDB: FOOD00403)

Bean

Green lentil (FooDB: FOOD00970)

Gourd

Watermelon (FooDB: FOOD00052)
Muskmelon (FooDB: FOOD00064)
Cucumber (FooDB: FOOD00065)
Cucurbita (FooDB: FOOD00066)
Bitter gourd (FooDB: FOOD00115)
Winter squash (FooDB: FOOD00283)
Butternut squash (FooDB: FOOD00317)
Calabash (FooDB: FOOD00318)
Chayote (FooDB: FOOD00325)
Towel gourd (FooDB: FOOD00492)
Wax gourd (FooDB: FOOD00499)
Tinda (FooDB: FOOD00559)
Horned melon (FooDB: FOOD00761)
Sunburst squash (pattypan squash) (FooDB: FOOD00874)
Green zucchini (FooDB: FOOD00875)
Yellow zucchini (FooDB: FOOD00876)
Japanese pumpkin (FooDB: FOOD00886)
Acorn squash (FooDB: FOOD00972)
Cantaloupe melon (FooDB: FOOD00984)

Coffee and coffee product

Coffee

Arabica coffee (FooDB: FOOD00059)
Robusta coffee (FooDB: FOOD00060)

Soy

Soy bean (FooDB: FOOD00085)

Soy product

Soy sauce (FooDB: FOOD00694)
Miso (FooDB: FOOD00695)
Tofu (FooDB: FOOD00696)
Soy milk (FooDB: FOOD00736)
Soy cream (FooDB: FOOD00784)

Dish

Other dish

Taco shell (FooDB: FOOD00991)
Tostada shell (FooDB: FOOD00992)

Tea

Herbal tea

Hibiscus tea (FooDB: FOOD00723)
Greenthread tea (FooDB: FOOD00820)

Baking good

Wrapper

Wonton wrapper (FooDB: FOOD00818)

Process

Naturally occurring process

Biological process

Biochemical pathway

Metabolic pathway

Starch and Sucrose Metabolism (HMDB: HMDB0003971)
D-Sorbitol Degradation II (PathBank: SMP0002036)
Fructose Metabolism (PathBank: SMP0002314)
Mannose Metabolism (PathBank: SMP0002315)
Amino Sugar and Nucleotide Sugar Metabolism (PathBank: SMP0002331)
Starch and Sucrose Metabolism (PathBank: SMP0002380)
Riboneogenesis (PathBank: SMP0002406)
Pentose Phosphate Pathway (PathBank: SMP0012443)

Starch and sucrose metabolism (HMDB: HMDB0003971)

Disease pathway

Glycogen Synthetase Deficiency (PathBank: SMP0000552)
Glycogenosis, Type III. Cori Disease, Debrancher Glycogenosis (PathBank: SMP0000553)
Glycogenosis, Type IV. Amylopectinosis, Anderson Disease (PathBank: SMP0000554)
Glycogenosis, Type VI. Hers Disease (PathBank: SMP0000555)
Mucopolysaccharidosis VI. Sly Syndrome (PathBank: SMP0000556)
Sucrase-Isomaltase Deficiency (PathBank: SMP0000557)

Role

Not Available

Physical Properties

State

Solid

Experimental Molecular Properties

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

Experimental Chromatographic Properties

Experimental Collision Cross Sections

Adduct Type	Data Source	CCS Value (Å²)	Reference
[M-H]-	MetCCS_train_neg	141.015	30932474
[M+H]+	MetCCS_train_pos	149.303	30932474
[M-H]-	Not Available	141.015	http://allccs.zhulab.cn/database/detail?ID=AllCCS00000399
[M+H]+	Not Available	149.494	http://allccs.zhulab.cn/database/detail?ID=AllCCS00000399

Predicted Molecular Properties

Property	Value	Source
Water Solubility	33.4 g/L	ALOGPS
logP	-2.1	ALOGPS
logP	-2.9	ChemAxon
logS	-0.89	ALOGPS
pKa (Strongest Acidic)	1.22	ChemAxon
pKa (Strongest Basic)	-3.5	ChemAxon
Physiological Charge	-2	ChemAxon
Hydrogen Acceptor Count	8	ChemAxon
Hydrogen Donor Count	6	ChemAxon
Polar Surface Area	156.91 Å²	ChemAxon
Rotatable Bond Count	4	ChemAxon
Refractivity	47.23 m³·mol⁻¹	ChemAxon
Polarizability	20.92 Å³	ChemAxon
Number of Rings	1	ChemAxon
Bioavailability	Yes	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]+	157.78	31661259
DarkChem	[M-H]-	151.147	31661259
DeepCCS	[M+H]+	147.394	30932474
DeepCCS	[M-H]-	145.101	30932474
DeepCCS	[M-2H]-	179.949	30932474
DeepCCS	[M+Na]+	154.161	30932474
AllCCS	[M+H]+	155.6	32859911
AllCCS	[M+H-H2O]+	152.1	32859911
AllCCS	[M+NH4]+	158.9	32859911
AllCCS	[M+Na]+	159.8	32859911
AllCCS	[M-H]-	147.2	32859911
AllCCS	[M+Na-2H]-	147.5	32859911
AllCCS	[M+HCOO]-	148.0	32859911

Predicted Kovats Retention Indices

Underivatized

Metabolite	SMILES	Kovats RI Value	Column Type	Reference
Beta-D-Fructose 6-phosphate	OC[C@@]1(O)O[C@H](COP(O)(O)=O)[C@@H](O)[C@@H]1O	3124.5	Standard polar	33892256
Beta-D-Fructose 6-phosphate	OC[C@@]1(O)O[C@H](COP(O)(O)=O)[C@@H](O)[C@@H]1O	2128.9	Standard non polar	33892256
Beta-D-Fructose 6-phosphate	OC[C@@]1(O)O[C@H](COP(O)(O)=O)[C@@H](O)[C@@H]1O	2224.7	Semi standard non polar	33892256

Derivatized

Derivative Name / Structure	SMILES	Kovats RI Value	Column Type	Reference
Beta-D-Fructose 6-phosphate,1TMS,isomer #1	C[Si](C)(C)OC[C@@]1(O)O[C@H](COP(=O)(O)O)[C@@H](O)[C@@H]1O	2230.4	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,1TMS,isomer #2	C[Si](C)(C)O[C@]1(CO)O[C@H](COP(=O)(O)O)[C@@H](O)[C@@H]1O	2229.9	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,1TMS,isomer #3	C[Si](C)(C)O[C@H]1[C@H](O)[C@@](O)(CO)O[C@@H]1COP(=O)(O)O	2205.3	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,1TMS,isomer #4	C[Si](C)(C)O[C@H]1[C@H](O)[C@@H](COP(=O)(O)O)O[C@]1(O)CO	2240.9	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,1TMS,isomer #5	C[Si](C)(C)OP(=O)(O)OC[C@H]1O[C@](O)(CO)[C@@H](O)[C@@H]1O	2263.9	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,2TMS,isomer #1	C[Si](C)(C)OC[C@@]1(O[Si](C)(C)C)O[C@H](COP(=O)(O)O)[C@@H](O)[C@@H]1O	2223.9	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,2TMS,isomer #10	C[Si](C)(C)O[C@H]1[C@H](O)[C@@H](COP(=O)(O)O[Si](C)(C)C)O[C@]1(O)CO	2288.4	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,2TMS,isomer #11	C[Si](C)(C)OP(=O)(OC[C@H]1O[C@](O)(CO)[C@@H](O)[C@@H]1O)O[Si](C)(C)C	2255.9	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,2TMS,isomer #2	C[Si](C)(C)OC[C@@]1(O)O[C@H](COP(=O)(O)O)[C@@H](O[Si](C)(C)C)[C@@H]1O	2200.1	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,2TMS,isomer #3	C[Si](C)(C)OC[C@@]1(O)O[C@H](COP(=O)(O)O)[C@@H](O)[C@@H]1O[Si](C)(C)C	2202.9	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,2TMS,isomer #4	C[Si](C)(C)OC[C@@]1(O)O[C@H](COP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@@H]1O	2271.5	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,2TMS,isomer #5	C[Si](C)(C)O[C@H]1[C@H](O)[C@](CO)(O[Si](C)(C)C)O[C@@H]1COP(=O)(O)O	2213.0	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,2TMS,isomer #6	C[Si](C)(C)O[C@H]1[C@H](O)[C@@H](COP(=O)(O)O)O[C@@]1(CO)O[Si](C)(C)C	2226.4	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,2TMS,isomer #7	C[Si](C)(C)O[C@]1(CO)O[C@H](COP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@@H]1O	2285.5	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,2TMS,isomer #8	C[Si](C)(C)O[C@H]1[C@H](O[Si](C)(C)C)[C@@H](COP(=O)(O)O)O[C@]1(O)CO	2198.2	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,2TMS,isomer #9	C[Si](C)(C)O[C@H]1[C@H](O)[C@@](O)(CO)O[C@@H]1COP(=O)(O)O[Si](C)(C)C	2251.6	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,3TMS,isomer #1	C[Si](C)(C)OC[C@@]1(O[Si](C)(C)C)O[C@H](COP(=O)(O)O)[C@@H](O[Si](C)(C)C)[C@@H]1O	2198.7	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,3TMS,isomer #10	C[Si](C)(C)O[C@H]1[C@H](O)[C@@H](COP(=O)(O)O[Si](C)(C)C)O[C@@]1(CO)O[Si](C)(C)C	2278.1	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,3TMS,isomer #11	C[Si](C)(C)O[C@]1(CO)O[C@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@@H]1O	2264.9	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,3TMS,isomer #12	C[Si](C)(C)O[C@H]1[C@H](O[Si](C)(C)C)[C@@H](COP(=O)(O)O[Si](C)(C)C)O[C@]1(O)CO	2247.8	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,3TMS,isomer #13	C[Si](C)(C)O[C@H]1[C@H](O)[C@@](O)(CO)O[C@@H]1COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	2231.1	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,3TMS,isomer #14	C[Si](C)(C)O[C@H]1[C@H](O)[C@@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@]1(O)CO	2280.4	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,3TMS,isomer #2	C[Si](C)(C)OC[C@@]1(O[Si](C)(C)C)O[C@H](COP(=O)(O)O)[C@@H](O)[C@@H]1O[Si](C)(C)C	2206.3	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,3TMS,isomer #3	C[Si](C)(C)OC[C@@]1(O[Si](C)(C)C)O[C@H](COP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@@H]1O	2259.4	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,3TMS,isomer #4	C[Si](C)(C)OC[C@@]1(O)O[C@H](COP(=O)(O)O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	2179.6	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,3TMS,isomer #5	C[Si](C)(C)OC[C@@]1(O)O[C@H](COP(=O)(O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	2237.6	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,3TMS,isomer #6	C[Si](C)(C)OC[C@@]1(O)O[C@H](COP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	2246.1	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,3TMS,isomer #7	C[Si](C)(C)OC[C@@]1(O)O[C@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@@H]1O	2233.4	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,3TMS,isomer #8	C[Si](C)(C)O[C@H]1[C@H](O[Si](C)(C)C)[C@@H](COP(=O)(O)O)O[C@@]1(CO)O[Si](C)(C)C	2217.1	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,3TMS,isomer #9	C[Si](C)(C)O[C@H]1[C@H](O)[C@](CO)(O[Si](C)(C)C)O[C@@H]1COP(=O)(O)O[Si](C)(C)C	2258.7	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,4TMS,isomer #1	C[Si](C)(C)OC[C@@]1(O[Si](C)(C)C)O[C@H](COP(=O)(O)O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	2195.0	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,4TMS,isomer #10	C[Si](C)(C)O[C@H]1[C@H](O)[C@@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@@]1(CO)O[Si](C)(C)C	2275.2	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,4TMS,isomer #11	C[Si](C)(C)O[C@H]1[C@H](O[Si](C)(C)C)[C@@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@]1(O)CO	2259.5	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,4TMS,isomer #2	C[Si](C)(C)OC[C@@]1(O[Si](C)(C)C)O[C@H](COP(=O)(O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	2251.2	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,4TMS,isomer #3	C[Si](C)(C)OC[C@@]1(O[Si](C)(C)C)O[C@H](COP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	2266.8	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,4TMS,isomer #4	C[Si](C)(C)OC[C@@]1(O[Si](C)(C)C)O[C@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@@H]1O	2262.8	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,4TMS,isomer #5	C[Si](C)(C)OC[C@@]1(O)O[C@H](COP(=O)(O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	2253.7	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,4TMS,isomer #6	C[Si](C)(C)OC[C@@]1(O)O[C@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	2263.0	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,4TMS,isomer #7	C[Si](C)(C)OC[C@@]1(O)O[C@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	2270.6	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,4TMS,isomer #8	C[Si](C)(C)O[C@H]1[C@H](O[Si](C)(C)C)[C@@H](COP(=O)(O)O[Si](C)(C)C)O[C@@]1(CO)O[Si](C)(C)C	2267.3	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,4TMS,isomer #9	C[Si](C)(C)O[C@H]1[C@H](O)[C@](CO)(O[Si](C)(C)C)O[C@@H]1COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	2251.9	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,5TMS,isomer #1	C[Si](C)(C)OC[C@@]1(O[Si](C)(C)C)O[C@H](COP(=O)(O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	2260.1	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,5TMS,isomer #1	C[Si](C)(C)OC[C@@]1(O[Si](C)(C)C)O[C@H](COP(=O)(O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	2154.4	Standard non polar	33892256
Beta-D-Fructose 6-phosphate,5TMS,isomer #1	C[Si](C)(C)OC[C@@]1(O[Si](C)(C)C)O[C@H](COP(=O)(O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	2543.4	Standard polar	33892256
Beta-D-Fructose 6-phosphate,5TMS,isomer #2	C[Si](C)(C)OC[C@@]1(O[Si](C)(C)C)O[C@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	2264.4	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,5TMS,isomer #2	C[Si](C)(C)OC[C@@]1(O[Si](C)(C)C)O[C@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	2166.7	Standard non polar	33892256
Beta-D-Fructose 6-phosphate,5TMS,isomer #2	C[Si](C)(C)OC[C@@]1(O[Si](C)(C)C)O[C@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	2456.3	Standard polar	33892256
Beta-D-Fructose 6-phosphate,5TMS,isomer #3	C[Si](C)(C)OC[C@@]1(O[Si](C)(C)C)O[C@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	2296.8	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,5TMS,isomer #3	C[Si](C)(C)OC[C@@]1(O[Si](C)(C)C)O[C@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	2186.5	Standard non polar	33892256
Beta-D-Fructose 6-phosphate,5TMS,isomer #3	C[Si](C)(C)OC[C@@]1(O[Si](C)(C)C)O[C@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	2462.0	Standard polar	33892256
Beta-D-Fructose 6-phosphate,5TMS,isomer #4	C[Si](C)(C)OC[C@@]1(O)O[C@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	2279.9	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,5TMS,isomer #4	C[Si](C)(C)OC[C@@]1(O)O[C@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	2139.3	Standard non polar	33892256
Beta-D-Fructose 6-phosphate,5TMS,isomer #4	C[Si](C)(C)OC[C@@]1(O)O[C@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	2396.5	Standard polar	33892256
Beta-D-Fructose 6-phosphate,5TMS,isomer #5	C[Si](C)(C)O[C@H]1[C@H](O[Si](C)(C)C)[C@@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@@]1(CO)O[Si](C)(C)C	2283.4	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,5TMS,isomer #5	C[Si](C)(C)O[C@H]1[C@H](O[Si](C)(C)C)[C@@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@@]1(CO)O[Si](C)(C)C	2164.1	Standard non polar	33892256
Beta-D-Fructose 6-phosphate,5TMS,isomer #5	C[Si](C)(C)O[C@H]1[C@H](O[Si](C)(C)C)[C@@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@@]1(CO)O[Si](C)(C)C	2409.4	Standard polar	33892256
Beta-D-Fructose 6-phosphate,6TMS,isomer #1	C[Si](C)(C)OC[C@@]1(O[Si](C)(C)C)O[C@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	2288.2	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,6TMS,isomer #1	C[Si](C)(C)OC[C@@]1(O[Si](C)(C)C)O[C@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	2200.0	Standard non polar	33892256
Beta-D-Fructose 6-phosphate,6TMS,isomer #1	C[Si](C)(C)OC[C@@]1(O[Si](C)(C)C)O[C@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	2373.9	Standard polar	33892256
Beta-D-Fructose 6-phosphate,1TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC[C@@]1(O)O[C@H](COP(=O)(O)O)[C@@H](O)[C@@H]1O	2459.7	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,1TBDMS,isomer #2	CC(C)(C)[Si](C)(C)O[C@]1(CO)O[C@H](COP(=O)(O)O)[C@@H](O)[C@@H]1O	2470.4	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,1TBDMS,isomer #3	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@@](O)(CO)O[C@@H]1COP(=O)(O)O	2457.8	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,1TBDMS,isomer #4	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@@H](COP(=O)(O)O)O[C@]1(O)CO	2487.1	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,1TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OP(=O)(O)OC[C@H]1O[C@](O)(CO)[C@@H](O)[C@@H]1O	2491.0	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,2TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC[C@@]1(O[Si](C)(C)C(C)(C)C)O[C@H](COP(=O)(O)O)[C@@H](O)[C@@H]1O	2601.3	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,2TBDMS,isomer #10	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@@H](COP(=O)(O)O[Si](C)(C)C(C)(C)C)O[C@]1(O)CO	2710.1	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,2TBDMS,isomer #11	CC(C)(C)[Si](C)(C)OP(=O)(OC[C@H]1O[C@](O)(CO)[C@@H](O)[C@@H]1O)O[Si](C)(C)C(C)(C)C	2683.6	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,2TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC[C@@]1(O)O[C@H](COP(=O)(O)O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	2604.6	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,2TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC[C@@]1(O)O[C@H](COP(=O)(O)O)[C@@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	2614.0	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,2TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC[C@@]1(O)O[C@H](COP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O	2686.2	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,2TBDMS,isomer #5	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@](CO)(O[Si](C)(C)C(C)(C)C)O[C@@H]1COP(=O)(O)O	2625.0	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,2TBDMS,isomer #6	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@@H](COP(=O)(O)O)O[C@@]1(CO)O[Si](C)(C)C(C)(C)C	2638.5	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,2TBDMS,isomer #7	CC(C)(C)[Si](C)(C)O[C@]1(CO)O[C@H](COP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O	2712.2	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,2TBDMS,isomer #8	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](COP(=O)(O)O)O[C@]1(O)CO	2635.8	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,2TBDMS,isomer #9	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@@](O)(CO)O[C@@H]1COP(=O)(O)O[Si](C)(C)C(C)(C)C	2676.2	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,3TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC[C@@]1(O[Si](C)(C)C(C)(C)C)O[C@H](COP(=O)(O)O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	2784.4	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,3TBDMS,isomer #10	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@@H](COP(=O)(O)O[Si](C)(C)C(C)(C)C)O[C@@]1(CO)O[Si](C)(C)C(C)(C)C	2895.5	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,3TBDMS,isomer #11	CC(C)(C)[Si](C)(C)O[C@]1(CO)O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O	2911.8	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,3TBDMS,isomer #12	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](COP(=O)(O)O[Si](C)(C)C(C)(C)C)O[C@]1(O)CO	2891.5	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,3TBDMS,isomer #13	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@@](O)(CO)O[C@@H]1COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	2873.3	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,3TBDMS,isomer #14	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@@H](COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)O[C@]1(O)CO	2905.1	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,3TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC[C@@]1(O[Si](C)(C)C(C)(C)C)O[C@H](COP(=O)(O)O)[C@@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	2789.9	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,3TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC[C@@]1(O[Si](C)(C)C(C)(C)C)O[C@H](COP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O	2872.1	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,3TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC[C@@]1(O)O[C@H](COP(=O)(O)O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O[Si](C)(C)C(C)(C)C	2799.4	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,3TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC[C@@]1(O)O[C@H](COP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	2866.0	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,3TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC[C@@]1(O)O[C@H](COP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	2869.5	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,3TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC[C@@]1(O)O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O	2868.3	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,3TBDMS,isomer #8	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](COP(=O)(O)O)O[C@@]1(CO)O[Si](C)(C)C(C)(C)C	2834.7	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,3TBDMS,isomer #9	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@](CO)(O[Si](C)(C)C(C)(C)C)O[C@@H]1COP(=O)(O)O[Si](C)(C)C(C)(C)C	2877.4	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,4TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC[C@@]1(O[Si](C)(C)C(C)(C)C)O[C@H](COP(=O)(O)O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O[Si](C)(C)C(C)(C)C	3011.3	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,4TBDMS,isomer #10	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@@H](COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)O[C@@]1(CO)O[Si](C)(C)C(C)(C)C	3109.5	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,4TBDMS,isomer #11	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)O[C@]1(O)CO	3096.8	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,4TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC[C@@]1(O[Si](C)(C)C(C)(C)C)O[C@H](COP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	3059.7	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,4TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC[C@@]1(O[Si](C)(C)C(C)(C)C)O[C@H](COP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	3063.8	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,4TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC[C@@]1(O[Si](C)(C)C(C)(C)C)O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O	3083.3	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,4TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC[C@@]1(O)O[C@H](COP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O[Si](C)(C)C(C)(C)C	3067.8	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,4TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC[C@@]1(O)O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	3069.2	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,4TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC[C@@]1(O)O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	3073.4	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,4TBDMS,isomer #8	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](COP(=O)(O)O[Si](C)(C)C(C)(C)C)O[C@@]1(CO)O[Si](C)(C)C(C)(C)C	3086.7	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,4TBDMS,isomer #9	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@](CO)(O[Si](C)(C)C(C)(C)C)O[C@@H]1COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	3084.2	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,5TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC[C@@]1(O[Si](C)(C)C(C)(C)C)O[C@H](COP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O[Si](C)(C)C(C)(C)C	3264.4	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,5TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC[C@@]1(O[Si](C)(C)C(C)(C)C)O[C@H](COP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O[Si](C)(C)C(C)(C)C	3032.3	Standard non polar	33892256
Beta-D-Fructose 6-phosphate,5TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC[C@@]1(O[Si](C)(C)C(C)(C)C)O[C@H](COP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O[Si](C)(C)C(C)(C)C	2962.3	Standard polar	33892256
Beta-D-Fructose 6-phosphate,5TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC[C@@]1(O[Si](C)(C)C(C)(C)C)O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	3260.5	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,5TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC[C@@]1(O[Si](C)(C)C(C)(C)C)O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	3005.1	Standard non polar	33892256
Beta-D-Fructose 6-phosphate,5TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC[C@@]1(O[Si](C)(C)C(C)(C)C)O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	2918.9	Standard polar	33892256
Beta-D-Fructose 6-phosphate,5TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC[C@@]1(O[Si](C)(C)C(C)(C)C)O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	3269.8	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,5TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC[C@@]1(O[Si](C)(C)C(C)(C)C)O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	3033.7	Standard non polar	33892256
Beta-D-Fructose 6-phosphate,5TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC[C@@]1(O[Si](C)(C)C(C)(C)C)O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	2924.9	Standard polar	33892256
Beta-D-Fructose 6-phosphate,5TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC[C@@]1(O)O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O[Si](C)(C)C(C)(C)C	3272.9	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,5TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC[C@@]1(O)O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O[Si](C)(C)C(C)(C)C	2989.9	Standard non polar	33892256
Beta-D-Fructose 6-phosphate,5TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC[C@@]1(O)O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O[Si](C)(C)C(C)(C)C	2876.9	Standard polar	33892256
Beta-D-Fructose 6-phosphate,5TBDMS,isomer #5	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)O[C@@]1(CO)O[Si](C)(C)C(C)(C)C	3275.9	Semi standard non polar	33892256
Beta-D-Fructose 6-phosphate,5TBDMS,isomer #5	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)O[C@@]1(CO)O[Si](C)(C)C(C)(C)C	3001.8	Standard non polar	33892256
Beta-D-Fructose 6-phosphate,5TBDMS,isomer #5	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)O[C@@]1(CO)O[Si](C)(C)C(C)(C)C	2875.6	Standard polar	33892256

Spectra

GC-MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Experimental GC-MS	GC-MS Spectrum - Beta-D-Fructose 6-phosphate GC-EI-TOF (Non-derivatized)	splash10-00di-9422000000-bee9b5c8192cd70afd4b	2017-09-12	HMDB team, MONA, MassBank	View Spectrum
Experimental GC-MS	GC-MS Spectrum - Beta-D-Fructose 6-phosphate GC-EI-TOF (Non-derivatized)	splash10-00di-9422000000-bee9b5c8192cd70afd4b	2018-05-18	HMDB team, MONA, MassBank	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Beta-D-Fructose 6-phosphate GC-MS (Non-derivatized) - 70eV, Positive	splash10-0005-9330000000-5c27e76b48f712dafdf1	2016-09-22	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Beta-D-Fructose 6-phosphate GC-MS (4 TMS) - 70eV, Positive	splash10-0540-8097650000-bd7cf45abb555a5c08da	2017-10-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Beta-D-Fructose 6-phosphate GC-MS (Non-derivatized) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum

MS/MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Experimental LC-MS/MS	LC-MS/MS Spectrum - Beta-D-Fructose 6-phosphate LC-ESI-ITFT , negative-QTOF	splash10-0002-9200000000-890d2bc5c099d333bb87	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Beta-D-Fructose 6-phosphate LC-ESI-ITFT , negative-QTOF	splash10-0a4i-0090000000-9e5a9a987b6541abb2c7	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Beta-D-Fructose 6-phosphate LC-ESI-ITFT , negative-QTOF	splash10-0ab9-0000509000-ba24f5137a9692d147ab	2017-09-14	HMDB team, MONA	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Beta-D-Fructose 6-phosphate 10V, Positive-QTOF	splash10-03di-2980000000-6b021fc643037857d79c	2015-09-14	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Beta-D-Fructose 6-phosphate 20V, Positive-QTOF	splash10-03dj-6950000000-9aeea6f58646b1ddfd2d	2015-09-14	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Beta-D-Fructose 6-phosphate 40V, Positive-QTOF	splash10-00ds-9300000000-163fede30ff57a757356	2015-09-14	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Beta-D-Fructose 6-phosphate 10V, Negative-QTOF	splash10-0a6r-7390000000-3b9471399e651e34edcb	2015-09-15	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Beta-D-Fructose 6-phosphate 20V, Negative-QTOF	splash10-004i-9000000000-107d49541ec3b4b1213f	2015-09-15	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Beta-D-Fructose 6-phosphate 40V, Negative-QTOF	splash10-004i-9000000000-9182363b16cd6b3e720b	2015-09-15	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Beta-D-Fructose 6-phosphate 10V, Negative-QTOF	splash10-0a4i-3090000000-7ae40fd439a28bd2393e	2021-09-22	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Beta-D-Fructose 6-phosphate 20V, Negative-QTOF	splash10-004i-9010000000-53fac253975be4bb66f7	2021-09-22	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Beta-D-Fructose 6-phosphate 40V, Negative-QTOF	splash10-004i-9000000000-a5e502a2627af2048a1f	2021-09-22	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Beta-D-Fructose 6-phosphate 10V, Positive-QTOF	splash10-03dj-1790000000-cf4773c8e21b0c55570e	2021-09-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Beta-D-Fructose 6-phosphate 20V, Positive-QTOF	splash10-0002-9810000000-21980e2a6a612b295b9d	2021-09-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Beta-D-Fructose 6-phosphate 40V, Positive-QTOF	splash10-000t-9000000000-a08dc200cb22f420d5bc	2021-09-23	Wishart Lab	View Spectrum

NMR Spectra

Spectrum Type	Description	Deposition Date	Source	View
Predicted 1D NMR	¹³C NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum

Biological Properties

Cellular Locations

Cytoplasm (predicted from logP)

Biospecimen Locations

Not Available

Tissue Locations

Prostate

Pathways

Name	SMPDB/PathBank	KEGG
Starch and Sucrose Metabolism
Glycogen synthetase deficiency		Not Available
Glycogenosis, Type III. Cori disease, Debrancher glycogenosis		Not Available
Glycogenosis, Type IV. Amylopectinosis, Anderson disease		Not Available
Glycogenosis, Type VI. Hers disease		Not Available

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

KNApSAcK ID

Chemspider ID

KEGG Compound ID

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Fructose_6-phosphate

METLIN ID

Not Available

PubChem Compound

440641

PDB ID

Not Available

ChEBI ID

16084

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

Sreekumar A, Poisson LM, Rajendiran TM, Khan AP, Cao Q, Yu J, Laxman B, Mehra R, Lonigro RJ, Li Y, Nyati MK, Ahsan A, Kalyana-Sundaram S, Han B, Cao X, Byun J, Omenn GS, Ghosh D, Pennathur S, Alexander DC, Berger A, Shuster JR, Wei JT, Varambally S, Beecher C, Chinnaiyan AM: Metabolomic profiles delineate potential role for sarcosine in prostate cancer progression. Nature. 2009 Feb 12;457(7231):910-4. doi: 10.1038/nature07762. [PubMed:19212411 ]
Roberts NB, Dutton J, Helliwell T, Rothwell PJ, Kavanagh JP: Pyrophosphate in synovial fluid and urine and its relationship to urinary risk factors for stone disease. Ann Clin Biochem. 1992 Sep;29 ( Pt 5):529-34. [PubMed:1332571 ]
Sanchez B, Champomier-Verges MC, Anglade P, Baraige F, de Los Reyes-Gavilan CG, Margolles A, Zagorec M: Proteomic analysis of global changes in protein expression during bile salt exposure of Bifidobacterium longum NCIMB 8809. J Bacteriol. 2005 Aug;187(16):5799-808. [PubMed:16077128 ]
Gagnon M, Kheadr EE, Le Blay G, Fliss I: In vitro inhibition of Escherichia coli O157:H7 by bifidobacterial strains of human origin. Int J Food Microbiol. 2004 Apr 1;92(1):69-78. [PubMed:15033269 ]

Only showing the first 10 proteins. There are 21 proteins in total.

Show all enzymes and transporters

Enzymes

Enzyme Details

1. Glucokinase

General function:: Involved in ATP binding
Specific function:: Catalyzes the initial step in utilization of glucose by the beta-cell and liver at physiological glucose concentration. Glucokinase has a high Km for glucose, and so it is effective only when glucose is abundant. The role of GCK is to provide G6P for the synthesis of glycogen. Pancreatic glucokinase plays an important role in modulating insulin secretion. Hepatic glucokinase helps to facilitate the uptake and conversion of glucose by acting as an insulin-sensitive determinant of hepatic glucose usage.
Gene Name:: GCK
Uniprot ID:: P35557
Molecular weight:: 52191.07

Enzyme Details

2. Hexokinase-3

General function:: Involved in ATP binding
Specific function:: Not Available
Gene Name:: HK3
Uniprot ID:: P52790
Molecular weight:: 99024.56

Reactions

Adenosine triphosphate + D-Fructose → ADP + Beta-D-Fructose 6-phosphate	details
Adenosine triphosphate + D-Fructose → ADP + Beta-D-Fructose 6-phosphate	details

Enzyme Details

3. Hexokinase-2

General function:: Involved in ATP binding
Specific function:: Not Available
Gene Name:: HK2
Uniprot ID:: P52789
Molecular weight:: 102379.06

Reactions

Adenosine triphosphate + D-Fructose → ADP + Beta-D-Fructose 6-phosphate	details
Adenosine triphosphate + D-Fructose → ADP + Beta-D-Fructose 6-phosphate	details

Enzyme Details

4. Hexokinase-1

General function:: Involved in ATP binding
Specific function:: Not Available
Gene Name:: HK1
Uniprot ID:: P19367
Molecular weight:: 102485.1

Reactions

Adenosine triphosphate + D-Fructose → ADP + Beta-D-Fructose 6-phosphate	details
Adenosine triphosphate + D-Fructose → ADP + Beta-D-Fructose 6-phosphate	details

Enzyme Details

5. 6-phosphofructokinase type C

General function:: Involved in 6-phosphofructokinase activity
Specific function:: Catalyzes the third step of glycolysis, the phosphorylation of fructose-6-phosphate (F6P) by ATP to generate fructose-1,6-bisphosphate (FBP) and ADP.
Gene Name:: PFKP
Uniprot ID:: Q01813
Molecular weight:: 85595.405

Reactions

Adenosine triphosphate + Beta-D-Fructose 6-phosphate → ADP + Fructose 1,6-bisphosphate	details

Enzyme Details

6. 6-phosphofructokinase, liver type

General function:: Involved in 6-phosphofructokinase activity
Specific function:: Catalyzes the third step of glycolysis, the phosphorylation of fructose-6-phosphate (F6P) by ATP to generate fructose-1,6-bisphosphate (FBP) and ADP.
Gene Name:: PFKL
Uniprot ID:: P17858
Molecular weight:: 85017.825

Reactions

Adenosine triphosphate + Beta-D-Fructose 6-phosphate → ADP + Fructose 1,6-bisphosphate	details

Enzyme Details

7. 6-phosphofructokinase, muscle type

General function:: Involved in 6-phosphofructokinase activity
Specific function:: Catalyzes the third step of glycolysis, the phosphorylation of fructose-6-phosphate (F6P) by ATP to generate fructose-1,6-bisphosphate (FBP) and ADP.
Gene Name:: PFKM
Uniprot ID:: P08237
Molecular weight:: 85181.925

Reactions

Adenosine triphosphate + Beta-D-Fructose 6-phosphate → ADP + Fructose 1,6-bisphosphate	details

Enzyme Details

8. 6-phosphofructo-2-kinase/fructose-2,6-bisphosphatase 3

General function:: Involved in catalytic activity
Specific function:: Synthesis and degradation of fructose 2,6-bisphosphate.
Gene Name:: PFKFB3
Uniprot ID:: Q16875
Molecular weight:: 57286.965

Reactions

D-Fructose 2,6-bisphosphate + Water → Beta-D-Fructose 6-phosphate + Phosphate	details

Enzyme Details

9. Mannose-6-phosphate isomerase

General function:: Involved in mannose-6-phosphate isomerase activity
Specific function:: Involved in the synthesis of the GDP-mannose and dolichol-phosphate-mannose required for a number of critical mannosyl transfer reactions.
Gene Name:: MPI
Uniprot ID:: P34949
Molecular weight:: 46655.44

Reactions

Mannose 6-phosphate → Beta-D-Fructose 6-phosphate	details

Enzyme Details

10. 6-phosphofructo-2-kinase/fructose-2,6-bisphosphatase 4

General function:: Involved in catalytic activity
Specific function:: Synthesis and degradation of fructose 2,6-bisphosphate.
Gene Name:: PFKFB4
Uniprot ID:: Q16877
Molecular weight:: 54039.34

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D-Fructose 2,6-bisphosphate + Water → Beta-D-Fructose 6-phosphate + Phosphate	details

Only showing the first 10 proteins. There are 21 proteins in total.

Show all enzymes and transporters

Showing metabocard for Beta-D-Fructose 6-phosphate (HMDB0003971)

MOL for HMDB0003971 (Beta-D-Fructose 6-phosphate)

3D MOL for HMDB0003971 (Beta-D-Fructose 6-phosphate)

3D SDF for HMDB0003971 (Beta-D-Fructose 6-phosphate)

3D-SDF for HMDB0003971 (Beta-D-Fructose 6-phosphate)

PDB for HMDB0003971 (Beta-D-Fructose 6-phosphate)

3D PDB for HMDB0003971 (Beta-D-Fructose 6-phosphate)

SMILES for HMDB0003971 (Beta-D-Fructose 6-phosphate)

INCHI for HMDB0003971 (Beta-D-Fructose 6-phosphate)

Structure for HMDB0003971 (Beta-D-Fructose 6-phosphate)

3D Structure for HMDB0003971 (Beta-D-Fructose 6-phosphate)

Experimental Collision Cross Sections

Predicted Collision Cross Sections

Predicted Kovats Retention Indices

Underivatized

Derivatized

GC-MS Spectra

MS/MS Spectra

NMR Spectra

Enzymes

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