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Identification Taxonomy Ontology Physical properties Spectra Biological properties Concentrations Links References enzymes (5) Show 5 proteins XML

Record Information

Version

5.0

Status

Expected but not Quantified

Creation Date

2005-11-16 15:48:42 UTC

Update Date

2021-09-14 15:44:55 UTC

HMDB ID

HMDB0001047

Secondary Accession Numbers

HMDB01047

Metabolite Identification

Common Name

D-Fructose 2,6-bisphosphate

Description

D-Fructose 2,6-bisphosphate (CAS: 77164-51-3), also known as phosphofructokinase activator, 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. D-Fructose 2,6-bisphosphate is a regulatory molecule controlling the activity of the enzyme phosphofructokinase-1 or PFK1 (in mammals). PFK1, in turn, is the key regulatory enzyme in the central metabolic pathway glycolysis. D-Fructose 2,6-bisphosphate has the effect of increasing the activity of PFK1, thus increasing the rate at which the principle food molecule glucose is broken down. At the same time, this regulatory molecule also inhibits the opposing enzyme (FBPase1) in the reverse pathway (gluconeogenesis) so that the synthesis of glucose is not taking place in the same cell where glucose is being broken down (which would be wasteful).

Structure

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

HMDB0001047
     RDKit          3D
D-Fructose 2,6-bisphosphate
 34 34  0  0  0  0  0  0  0  0999 V2000
    3.7742   -2.1374    1.1187 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1654   -0.6901    0.8552 P   0  0  0  0  0  5  0  0  0  0  0  0
    4.3255    0.0615    2.3701 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.6570   -0.7019    0.0781 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9941    0.1007   -0.0643 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7845   -0.5616    0.1155 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6594    0.0699   -0.6699 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.4980   -0.6273   -0.4493 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5695    0.2079   -0.5142 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.5574   -0.1941   -1.6180 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9741   -0.1818   -2.8633 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3163    0.2725    0.6575 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9591   -1.1773    1.1398 P   0  0  0  0  0  5  0  0  0  0  0  0
   -2.0799   -2.3635    0.8544 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4705   -1.4571    0.4287 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2277   -1.1034    2.8264 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0613    1.6154   -0.7657 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.7804    2.5620   -0.0622 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3592    1.4747   -0.1976 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.2043    2.4206   -0.7602 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0907   -0.3555    2.8318 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6452   -0.1611   -0.7325 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5028   -0.6171    1.1801 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8875   -1.6057   -0.2542 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9504    0.1509   -1.7410 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9157   -1.2161   -1.3190 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4512    0.4582   -1.5398 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0806   -0.5677   -2.7997 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8476   -2.3046    0.7725 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3576   -0.1780    3.1347 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9884    1.8385   -1.8385 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2303    3.3729    0.0123 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3193    1.5246    0.9009 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0458    2.0713   -1.0871 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  0
 10 11  1  0
  9 12  1  1
 12 13  1  0
 13 14  2  0
 13 15  1  0
 13 16  1  0
  9 17  1  0
 17 18  1  0
 17 19  1  0
 19 20  1  0
 19  7  1  0
  3 21  1  0
  4 22  1  0
  6 23  1  0
  6 24  1  0
  7 25  1  6
 10 26  1  0
 10 27  1  0
 11 28  1  0
 15 29  1  0
 16 30  1  0
 17 31  1  6
 18 32  1  0
 19 33  1  1
 20 34  1  0
M  END


  Mrv1652307232018072D          

 20 20  0  0  0  0            999 V2000
10001.8007 9999.4606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10002.5163 9999.8712    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
10002.103310000.5839    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10003.2318 9999.4585    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10002.927210000.5839    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10001.700610000.5365    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
10001.700610001.3604    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10001.2346 9998.6878    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 9999.4489 9998.6795    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 9998.938110000.5365    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9998.225410000.1246    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 9997.512810000.5365    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
 9997.924710001.2512    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 9996.798110000.1246    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 9997.100910001.2512    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10000.323410000.6191    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10000.990810000.1341    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
10000.7359 9999.3495    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
 9999.9109 9999.3495    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
 9999.656010000.1341    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  2  4  1  0  0  0  0
  2  5  1  0  0  0  0
  6  7  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 12 14  1  0  0  0  0
 12 15  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 16 17  1  0  0  0  0
 16 20  1  0  0  0  0
 17  1  1  1  0  0  0
 17  6  1  0  0  0  0
 18  8  1  1  0  0  0
 19  9  1  6  0  0  0
 20 10  1  1  0  0  0
M  END
> <DATABASE_ID>
HMDB0001047

> <DATABASE_NAME>
hmdb

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

> <INCHI_IDENTIFIER>
InChI=1S/C6H14O12P2/c7-2-6(18-20(13,14)15)5(9)4(8)3(17-6)1-16-19(10,11)12/h3-5,7-9H,1-2H2,(H2,10,11,12)(H2,13,14,15)/t3-,4-,5+,6+/m1/s1

> <INCHI_KEY>
YXWOAJXNVLXPMU-ZXXMMSQZSA-N

> <FORMULA>
C6H14O12P2

> <MOLECULAR_WEIGHT>
340.1157

> <EXACT_MASS>
339.996048936

> <JCHEM_ACCEPTOR_COUNT>
10

> <JCHEM_ATOM_COUNT>
34

> <JCHEM_AVERAGE_POLARIZABILITY>
25.243417387291053

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
7

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

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

> <ALOGPS_LOGP>
-1.50

> <JCHEM_LOGP>
-3.0051313806666666

> <ALOGPS_LOGS>
-1.33

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
1

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-4

> <JCHEM_PKA>
1.3703815262407373

> <JCHEM_PKA_STRONGEST_ACIDIC>
0.6839676218192321

> <JCHEM_PKA_STRONGEST_BASIC>
-3.4678657648404636

> <JCHEM_POLAR_SURFACE_AREA>
203.43999999999997

> <JCHEM_REFRACTIVITY>
58.1066

> <JCHEM_ROTATABLE_BOND_COUNT>
6

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
1.58e+01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
fructose-2,6-diphosphate

> <JCHEM_VEBER_RULE>
0

$$$$

HMDB0001047
     RDKit          3D
D-Fructose 2,6-bisphosphate
 34 34  0  0  0  0  0  0  0  0999 V2000
    3.7742   -2.1374    1.1187 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1654   -0.6901    0.8552 P   0  0  0  0  0  5  0  0  0  0  0  0
    4.3255    0.0615    2.3701 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.6570   -0.7019    0.0781 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9941    0.1007   -0.0643 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7845   -0.5616    0.1155 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6594    0.0699   -0.6699 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.4980   -0.6273   -0.4493 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5695    0.2079   -0.5142 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.5574   -0.1941   -1.6180 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9741   -0.1818   -2.8633 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3163    0.2725    0.6575 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9591   -1.1773    1.1398 P   0  0  0  0  0  5  0  0  0  0  0  0
   -2.0799   -2.3635    0.8544 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4705   -1.4571    0.4287 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2277   -1.1034    2.8264 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0613    1.6154   -0.7657 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.7804    2.5620   -0.0622 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3592    1.4747   -0.1976 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.2043    2.4206   -0.7602 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0907   -0.3555    2.8318 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6452   -0.1611   -0.7325 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5028   -0.6171    1.1801 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8875   -1.6057   -0.2542 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9504    0.1509   -1.7410 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9157   -1.2161   -1.3190 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4512    0.4582   -1.5398 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0806   -0.5677   -2.7997 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8476   -2.3046    0.7725 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3576   -0.1780    3.1347 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9884    1.8385   -1.8385 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2303    3.3729    0.0123 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3193    1.5246    0.9009 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0458    2.0713   -1.0871 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  0
 10 11  1  0
  9 12  1  1
 12 13  1  0
 13 14  2  0
 13 15  1  0
 13 16  1  0
  9 17  1  0
 17 18  1  0
 17 19  1  0
 19 20  1  0
 19  7  1  0
  3 21  1  0
  4 22  1  0
  6 23  1  0
  6 24  1  0
  7 25  1  6
 10 26  1  0
 10 27  1  0
 11 28  1  0
 15 29  1  0
 16 30  1  0
 17 31  1  6
 18 32  1  0
 19 33  1  1
 20 34  1  0
M  END

HEADER    PROTEIN                                 23-JUL-20   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   23-JUL-20         0                                  
HETATM    1  O   UNK     0    8670.0288665.660   0.000  0.00  0.00           O+0
HETATM    2  P   UNK     0    8671.3648666.426   0.000  0.00  0.00           P+0
HETATM    3  O   UNK     0    8670.5938667.757   0.000  0.00  0.00           O+0
HETATM    4  O   UNK     0    8672.6998665.656   0.000  0.00  0.00           O+0
HETATM    5  O   UNK     0    8672.1318667.757   0.000  0.00  0.00           O+0
HETATM    6  C   UNK     0    8669.8418667.668   0.000  0.00  0.00           C+0
HETATM    7  O   UNK     0    8669.8418669.206   0.000  0.00  0.00           O+0
HETATM    8  O   UNK     0    8668.9718664.217   0.000  0.00  0.00           O+0
HETATM    9  O   UNK     0    8665.6388664.202   0.000  0.00  0.00           O+0
HETATM   10  C   UNK     0    8664.6848667.668   0.000  0.00  0.00           C+0
HETATM   11  O   UNK     0    8663.3548666.899   0.000  0.00  0.00           O+0
HETATM   12  P   UNK     0    8662.0248667.668   0.000  0.00  0.00           P+0
HETATM   13  O   UNK     0    8662.7938669.002   0.000  0.00  0.00           O+0
HETATM   14  O   UNK     0    8660.6908666.899   0.000  0.00  0.00           O+0
HETATM   15  O   UNK     0    8661.2558669.002   0.000  0.00  0.00           O+0
HETATM   16  O   UNK     0    8667.2708667.822   0.000  0.00  0.00           O+0
HETATM   17  C   UNK     0    8668.5168666.917   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0    8668.0408665.452   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0    8666.5008665.452   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0    8666.0258666.917   0.000  0.00  0.00           C+0
CONECT    1    2   17                                                       
CONECT    2    1    3    4    5                                             
CONECT    3    2                                                            
CONECT    4    2                                                            
CONECT    5    2                                                            
CONECT    6    7   17                                                       
CONECT    7    6                                                            
CONECT    8   18                                                            
CONECT    9   19                                                            
CONECT   10   11   20                                                       
CONECT   11   10   12                                                       
CONECT   12   11   13   14   15                                             
CONECT   13   12                                                            
CONECT   14   12                                                            
CONECT   15   12                                                            
CONECT   16   17   20                                                       
CONECT   17   18   16    1    6                                             
CONECT   18   17   19    8                                                  
CONECT   19   18   20    9                                                  
CONECT   20   19   16   10                                                  
MASTER        0    0    0    0    0    0    0    0   20    0   40    0
END

COMPND    HMDB0001047
HETATM    1  O1  UNL     1       3.774  -2.137   1.119  1.00  0.00           O  
HETATM    2  P1  UNL     1       4.165  -0.690   0.855  1.00  0.00           P  
HETATM    3  O2  UNL     1       4.326   0.062   2.370  1.00  0.00           O  
HETATM    4  O3  UNL     1       5.657  -0.702   0.078  1.00  0.00           O  
HETATM    5  O4  UNL     1       2.994   0.101  -0.064  1.00  0.00           O  
HETATM    6  C1  UNL     1       1.785  -0.562   0.116  1.00  0.00           C  
HETATM    7  C2  UNL     1       0.659   0.070  -0.670  1.00  0.00           C  
HETATM    8  O5  UNL     1      -0.498  -0.627  -0.449  1.00  0.00           O  
HETATM    9  C3  UNL     1      -1.569   0.208  -0.514  1.00  0.00           C  
HETATM   10  C4  UNL     1      -2.557  -0.194  -1.618  1.00  0.00           C  
HETATM   11  O6  UNL     1      -1.974  -0.182  -2.863  1.00  0.00           O  
HETATM   12  O7  UNL     1      -2.316   0.272   0.658  1.00  0.00           O  
HETATM   13  P2  UNL     1      -2.959  -1.177   1.140  1.00  0.00           P  
HETATM   14  O8  UNL     1      -2.080  -2.363   0.854  1.00  0.00           O  
HETATM   15  O9  UNL     1      -4.470  -1.457   0.429  1.00  0.00           O  
HETATM   16  O10 UNL     1      -3.228  -1.103   2.826  1.00  0.00           O  
HETATM   17  C5  UNL     1      -1.061   1.615  -0.766  1.00  0.00           C  
HETATM   18  O11 UNL     1      -1.780   2.562  -0.062  1.00  0.00           O  
HETATM   19  C6  UNL     1       0.359   1.475  -0.198  1.00  0.00           C  
HETATM   20  O12 UNL     1       1.204   2.421  -0.760  1.00  0.00           O  
HETATM   21  H1  UNL     1       5.091  -0.355   2.832  1.00  0.00           H  
HETATM   22  H2  UNL     1       5.645  -0.161  -0.732  1.00  0.00           H  
HETATM   23  H3  UNL     1       1.503  -0.617   1.180  1.00  0.00           H  
HETATM   24  H4  UNL     1       1.888  -1.606  -0.254  1.00  0.00           H  
HETATM   25  H5  UNL     1       0.950   0.151  -1.741  1.00  0.00           H  
HETATM   26  H6  UNL     1      -2.916  -1.216  -1.319  1.00  0.00           H  
HETATM   27  H7  UNL     1      -3.451   0.458  -1.540  1.00  0.00           H  
HETATM   28  H8  UNL     1      -1.081  -0.568  -2.800  1.00  0.00           H  
HETATM   29  H9  UNL     1      -4.848  -2.305   0.772  1.00  0.00           H  
HETATM   30  H10 UNL     1      -3.358  -0.178   3.135  1.00  0.00           H  
HETATM   31  H11 UNL     1      -0.988   1.838  -1.839  1.00  0.00           H  
HETATM   32  H12 UNL     1      -1.230   3.373   0.012  1.00  0.00           H  
HETATM   33  H13 UNL     1       0.319   1.525   0.901  1.00  0.00           H  
HETATM   34  H14 UNL     1       2.046   2.071  -1.087  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3    4    5
CONECT    3   21
CONECT    4   22
CONECT    5    6
CONECT    6    7   23   24
CONECT    7    8   19   25
CONECT    8    9
CONECT    9   10   12   17
CONECT   10   11   26   27
CONECT   11   28
CONECT   12   13
CONECT   13   14   14   15   16
CONECT   15   29
CONECT   16   30
CONECT   17   18   19   31
CONECT   18   32
CONECT   19   20   33
CONECT   20   34
END

HMDB0001047
     RDKit          3D
D-Fructose 2,6-bisphosphate
 34 34  0  0  0  0  0  0  0  0999 V2000
    3.7742   -2.1374    1.1187 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1654   -0.6901    0.8552 P   0  0  0  0  0  5  0  0  0  0  0  0
    4.3255    0.0615    2.3701 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.6570   -0.7019    0.0781 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9941    0.1007   -0.0643 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7845   -0.5616    0.1155 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6594    0.0699   -0.6699 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.4980   -0.6273   -0.4493 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5695    0.2079   -0.5142 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.5574   -0.1941   -1.6180 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9741   -0.1818   -2.8633 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3163    0.2725    0.6575 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9591   -1.1773    1.1398 P   0  0  0  0  0  5  0  0  0  0  0  0
   -2.0799   -2.3635    0.8544 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4705   -1.4571    0.4287 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2277   -1.1034    2.8264 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0613    1.6154   -0.7657 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.7804    2.5620   -0.0622 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3592    1.4747   -0.1976 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.2043    2.4206   -0.7602 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0907   -0.3555    2.8318 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6452   -0.1611   -0.7325 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5028   -0.6171    1.1801 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8875   -1.6057   -0.2542 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9504    0.1509   -1.7410 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9157   -1.2161   -1.3190 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4512    0.4582   -1.5398 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0806   -0.5677   -2.7997 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8476   -2.3046    0.7725 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3576   -0.1780    3.1347 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9884    1.8385   -1.8385 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2303    3.3729    0.0123 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3193    1.5246    0.9009 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0458    2.0713   -1.0871 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  0
 10 11  1  0
  9 12  1  1
 12 13  1  0
 13 14  2  0
 13 15  1  0
 13 16  1  0
  9 17  1  0
 17 18  1  0
 17 19  1  0
 19 20  1  0
 19  7  1  0
  3 21  1  0
  4 22  1  0
  6 23  1  0
  6 24  1  0
  7 25  1  6
 10 26  1  0
 10 27  1  0
 11 28  1  0
 15 29  1  0
 16 30  1  0
 17 31  1  6
 18 32  1  0
 19 33  1  1
 20 34  1  0
M  END

View in JSmol View NMR Assignments View Stereo Labels

Synonyms

Value	Source
2,6-Di-O-phosphono-beta-D-fructofuranose	ChEBI
2,6-Di-O-phosphono-b-D-fructofuranose	Generator
2,6-Di-O-phosphono-β-D-fructofuranose	Generator
D-Fructose 2,6-bisphosphoric acid	Generator
b-D-Fructose 2,6-bisphosphate	HMDB
beta-D-Fructose 2,6-bisphosphate	HMDB
Fru 2,6-P2, fructose 2,6-diphosphate	HMDB
Fructose 2,6-bisphosphate	HMDB
Fructose 2,6-biphosphate	MeSH, HMDB
Fructose 2,6-diphosphate	MeSH, HMDB
Phosphofructokinase activation factor	MeSH, HMDB
Phosphofructokinase activator	MeSH, HMDB
Fructose-2,6-diphosphate	MeSH, HMDB
D-Fructose 2,6-diphosphate	HMDB
beta-D-Fructose 2,6-diphosphate	HMDB
β-D-Fructose 2,6-diphosphate	HMDB

Chemical Formula

C₆H₁₄O₁₂P₂

Average Molecular Weight

340.1157

Monoisotopic Molecular Weight

339.996048936

IUPAC Name

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

Traditional Name

fructose-2,6-diphosphate

CAS Registry Number

79082-92-1

SMILES

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

InChI Identifier

InChI=1S/C6H14O12P2/c7-2-6(18-20(13,14)15)5(9)4(8)3(17-6)1-16-19(10,11)12/h3-5,7-9H,1-2H2,(H2,10,11,12)(H2,13,14,15)/t3-,4-,5+,6+/m1/s1

InChI Key

YXWOAJXNVLXPMU-ZXXMMSQZSA-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
Organoheterocyclic compound
Oxacycle
Primary alcohol
Alcohol
Hydrocarbon derivative
Organic oxide
Aliphatic heteromonocyclic compound

Molecular Framework

Aliphatic heteromonocyclic compounds

External Descriptors

D-fructofuranose 2,6-bisphosphate (CHEBI:28602 )

Ontology

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

Not Available

Predicted Molecular Properties

Property	Value	Source
Water Solubility	15.8 g/L	ALOGPS
logP	-1.5	ALOGPS
logP	-3	ChemAxon
logS	-1.3	ALOGPS
pKa (Strongest Acidic)	0.68	ChemAxon
pKa (Strongest Basic)	-3.5	ChemAxon
Physiological Charge	-4	ChemAxon
Hydrogen Acceptor Count	10	ChemAxon
Hydrogen Donor Count	7	ChemAxon
Polar Surface Area	203.44 Å²	ChemAxon
Rotatable Bond Count	6	ChemAxon
Refractivity	58.11 m³·mol⁻¹	ChemAxon
Polarizability	25.24 Å³	ChemAxon
Number of Rings	1	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]+	172.908	31661259
DarkChem	[M-H]-	165.72	31661259
AllCCS	[M+H]+	170.022	32859911
AllCCS	[M-H]-	159.652	32859911
DeepCCS	[M+H]+	148.507	30932474
DeepCCS	[M-H]-	146.193	30932474
DeepCCS	[M-2H]-	180.861	30932474
DeepCCS	[M+Na]+	155.116	30932474
AllCCS	[M+H]+	170.0	32859911
AllCCS	[M+H-H2O]+	167.0	32859911
AllCCS	[M+NH4]+	172.8	32859911
AllCCS	[M+Na]+	173.6	32859911
AllCCS	[M-H]-	159.7	32859911
AllCCS	[M+Na-2H]-	159.7	32859911
AllCCS	[M+HCOO]-	159.9	32859911

Predicted Kovats Retention Indices

Underivatized

Metabolite	SMILES	Kovats RI Value	Column Type	Reference
D-Fructose 2,6-bisphosphate	OC[C@@]1(OP(O)(O)=O)O[C@H](COP(O)(O)=O)[C@@H](O)[C@@H]1O	3162.0	Standard polar	33892256
D-Fructose 2,6-bisphosphate	OC[C@@]1(OP(O)(O)=O)O[C@H](COP(O)(O)=O)[C@@H](O)[C@@H]1O	2350.5	Standard non polar	33892256
D-Fructose 2,6-bisphosphate	OC[C@@]1(OP(O)(O)=O)O[C@H](COP(O)(O)=O)[C@@H](O)[C@@H]1O	2808.9	Semi standard non polar	33892256

Derivatized

Derivative Name / Structure	SMILES	Kovats RI Value	Column Type	Reference
D-Fructose 2,6-bisphosphate,1TMS,isomer #1	C[Si](C)(C)OC[C@@]1(OP(=O)(O)O)O[C@H](COP(=O)(O)O)[C@@H](O)[C@@H]1O	2663.5	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,1TMS,isomer #2	C[Si](C)(C)O[C@H]1[C@H](O)[C@](CO)(OP(=O)(O)O)O[C@@H]1COP(=O)(O)O	2643.9	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,1TMS,isomer #3	C[Si](C)(C)O[C@H]1[C@H](O)[C@@H](COP(=O)(O)O)O[C@@]1(CO)OP(=O)(O)O	2674.5	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,1TMS,isomer #4	C[Si](C)(C)OP(=O)(O)O[C@]1(CO)O[C@H](COP(=O)(O)O)[C@@H](O)[C@@H]1O	2700.4	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,1TMS,isomer #5	C[Si](C)(C)OP(=O)(O)OC[C@H]1O[C@@](CO)(OP(=O)(O)O)[C@@H](O)[C@@H]1O	2792.0	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,2TMS,isomer #1	C[Si](C)(C)OC[C@@]1(OP(=O)(O)O)O[C@H](COP(=O)(O)O)[C@@H](O[Si](C)(C)C)[C@@H]1O	2577.9	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,2TMS,isomer #10	C[Si](C)(C)OP(=O)(O[C@]1(CO)O[C@H](COP(=O)(O)O)[C@@H](O)[C@@H]1O)O[Si](C)(C)C	2659.8	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,2TMS,isomer #11	C[Si](C)(C)OP(=O)(O)OC[C@H]1O[C@@](CO)(OP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@@H]1O	2772.4	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,2TMS,isomer #12	C[Si](C)(C)OP(=O)(OC[C@H]1O[C@@](CO)(OP(=O)(O)O)[C@@H](O)[C@@H]1O)O[Si](C)(C)C	2762.9	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,2TMS,isomer #2	C[Si](C)(C)OC[C@@]1(OP(=O)(O)O)O[C@H](COP(=O)(O)O)[C@@H](O)[C@@H]1O[Si](C)(C)C	2594.7	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,2TMS,isomer #3	C[Si](C)(C)OC[C@@]1(OP(=O)(O)O[Si](C)(C)C)O[C@H](COP(=O)(O)O)[C@@H](O)[C@@H]1O	2639.8	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,2TMS,isomer #4	C[Si](C)(C)OC[C@@]1(OP(=O)(O)O)O[C@H](COP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@@H]1O	2717.8	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,2TMS,isomer #5	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)OP(=O)(O)O	2594.7	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,2TMS,isomer #6	C[Si](C)(C)O[C@H]1[C@H](O)[C@](CO)(OP(=O)(O)O[Si](C)(C)C)O[C@@H]1COP(=O)(O)O	2630.5	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,2TMS,isomer #7	C[Si](C)(C)O[C@H]1[C@H](O)[C@](CO)(OP(=O)(O)O)O[C@@H]1COP(=O)(O)O[Si](C)(C)C	2699.4	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,2TMS,isomer #8	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)OP(=O)(O)O	2731.3	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,2TMS,isomer #9	C[Si](C)(C)O[C@H]1[C@H](O)[C@@H](COP(=O)(O)O)O[C@@]1(CO)OP(=O)(O)O[Si](C)(C)C	2656.2	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,3TMS,isomer #1	C[Si](C)(C)OC[C@@]1(OP(=O)(O)O)O[C@H](COP(=O)(O)O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	2525.1	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,3TMS,isomer #10	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)OP(=O)(O)O[Si](C)(C)C	2549.2	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,3TMS,isomer #11	C[Si](C)(C)O[C@H]1[C@H](O)[C@](CO)(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@@H]1COP(=O)(O)O	2548.0	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,3TMS,isomer #12	C[Si](C)(C)O[C@H]1[C@H](O)[C@](CO)(OP(=O)(O)O[Si](C)(C)C)O[C@@H]1COP(=O)(O)O[Si](C)(C)C	2633.1	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,3TMS,isomer #13	C[Si](C)(C)O[C@H]1[C@H](O)[C@](CO)(OP(=O)(O)O)O[C@@H]1COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	2641.8	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,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(CO)OP(=O)(O)O	2672.0	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,3TMS,isomer #15	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)OP(=O)(O)O[Si](C)(C)C	2665.7	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,3TMS,isomer #16	C[Si](C)(C)O[C@H]1[C@H](O)[C@@H](COP(=O)(O)O)O[C@@]1(CO)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	2590.6	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,3TMS,isomer #17	C[Si](C)(C)OP(=O)(O)OC[C@H]1O[C@@](CO)(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@@H]1O	2670.3	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,3TMS,isomer #18	C[Si](C)(C)OP(=O)(O)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	2703.9	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,3TMS,isomer #2	C[Si](C)(C)OC[C@@]1(OP(=O)(O)O[Si](C)(C)C)O[C@H](COP(=O)(O)O)[C@@H](O[Si](C)(C)C)[C@@H]1O	2533.7	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,3TMS,isomer #3	C[Si](C)(C)OC[C@@]1(OP(=O)(O)O)O[C@H](COP(=O)(O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	2595.0	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,3TMS,isomer #4	C[Si](C)(C)OC[C@@]1(OP(=O)(O)O[Si](C)(C)C)O[C@H](COP(=O)(O)O)[C@@H](O)[C@@H]1O[Si](C)(C)C	2555.7	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,3TMS,isomer #5	C[Si](C)(C)OC[C@@]1(OP(=O)(O)O)O[C@H](COP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	2609.5	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,3TMS,isomer #6	C[Si](C)(C)OC[C@@]1(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](COP(=O)(O)O)[C@@H](O)[C@@H]1O	2547.0	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,3TMS,isomer #7	C[Si](C)(C)OC[C@@]1(OP(=O)(O)O[Si](C)(C)C)O[C@H](COP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@@H]1O	2639.1	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,3TMS,isomer #8	C[Si](C)(C)OC[C@@]1(OP(=O)(O)O)O[C@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@@H]1O	2640.6	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,3TMS,isomer #9	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)OP(=O)(O)O	2608.1	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #1	C[Si](C)(C)OC[C@@]1(OP(=O)(O)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	2526.6	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #1	C[Si](C)(C)OC[C@@]1(OP(=O)(O)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	2479.0	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #1	C[Si](C)(C)OC[C@@]1(OP(=O)(O)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	3614.4	Standard polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #10	C[Si](C)(C)OC[C@@]1(OP(=O)(O)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	2602.6	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #10	C[Si](C)(C)OC[C@@]1(OP(=O)(O)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	2547.2	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #10	C[Si](C)(C)OC[C@@]1(OP(=O)(O)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	3391.4	Standard polar	33892256
D-Fructose 2,6-bisphosphate,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(CO)OP(=O)(O)O	2617.8	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,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(CO)OP(=O)(O)O	2491.7	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,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(CO)OP(=O)(O)O	3404.4	Standard polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,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(CO)OP(=O)(O)O[Si](C)(C)C	2611.8	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,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(CO)OP(=O)(O)O[Si](C)(C)C	2473.9	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,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(CO)OP(=O)(O)O[Si](C)(C)C	3454.8	Standard polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #13	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)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	2531.2	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #13	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)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	2524.7	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #13	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)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	3466.8	Standard polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #14	C[Si](C)(C)O[C@H]1[C@H](O)[C@](CO)(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@@H]1COP(=O)(O)O[Si](C)(C)C	2604.5	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #14	C[Si](C)(C)O[C@H]1[C@H](O)[C@](CO)(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@@H]1COP(=O)(O)O[Si](C)(C)C	2545.7	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #14	C[Si](C)(C)O[C@H]1[C@H](O)[C@](CO)(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@@H]1COP(=O)(O)O[Si](C)(C)C	3353.2	Standard polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #15	C[Si](C)(C)O[C@H]1[C@H](O)[C@](CO)(OP(=O)(O)O[Si](C)(C)C)O[C@@H]1COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	2617.9	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #15	C[Si](C)(C)O[C@H]1[C@H](O)[C@](CO)(OP(=O)(O)O[Si](C)(C)C)O[C@@H]1COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	2523.0	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #15	C[Si](C)(C)O[C@H]1[C@H](O)[C@](CO)(OP(=O)(O)O[Si](C)(C)C)O[C@@H]1COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	3328.9	Standard polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #16	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)OP(=O)(O)O[Si](C)(C)C	2652.7	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #16	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)OP(=O)(O)O[Si](C)(C)C	2532.6	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #16	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)OP(=O)(O)O[Si](C)(C)C	3324.0	Standard polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #17	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)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	2636.7	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #17	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)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	2555.7	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #17	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)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	3347.4	Standard polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #18	C[Si](C)(C)OP(=O)(OC[C@H]1O[C@@](CO)(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@@H]1O)O[Si](C)(C)C	2635.0	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #18	C[Si](C)(C)OP(=O)(OC[C@H]1O[C@@](CO)(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@@H]1O)O[Si](C)(C)C	2605.5	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #18	C[Si](C)(C)OP(=O)(OC[C@H]1O[C@@](CO)(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@@H]1O)O[Si](C)(C)C	3256.7	Standard polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #2	C[Si](C)(C)OC[C@@]1(OP(=O)(O)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	2580.3	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #2	C[Si](C)(C)OC[C@@]1(OP(=O)(O)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	2462.6	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #2	C[Si](C)(C)OC[C@@]1(OP(=O)(O)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	3574.2	Standard polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #3	C[Si](C)(C)OC[C@@]1(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](COP(=O)(O)O)[C@@H](O[Si](C)(C)C)[C@@H]1O	2509.0	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #3	C[Si](C)(C)OC[C@@]1(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](COP(=O)(O)O)[C@@H](O[Si](C)(C)C)[C@@H]1O	2551.1	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #3	C[Si](C)(C)OC[C@@]1(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](COP(=O)(O)O)[C@@H](O[Si](C)(C)C)[C@@H]1O	3503.0	Standard polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #4	C[Si](C)(C)OC[C@@]1(OP(=O)(O)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	2583.2	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #4	C[Si](C)(C)OC[C@@]1(OP(=O)(O)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	2494.6	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #4	C[Si](C)(C)OC[C@@]1(OP(=O)(O)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	3485.0	Standard polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #5	C[Si](C)(C)OC[C@@]1(OP(=O)(O)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	2585.9	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #5	C[Si](C)(C)OC[C@@]1(OP(=O)(O)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	2511.3	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #5	C[Si](C)(C)OC[C@@]1(OP(=O)(O)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	3433.7	Standard polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #6	C[Si](C)(C)OC[C@@]1(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](COP(=O)(O)O)[C@@H](O)[C@@H]1O[Si](C)(C)C	2536.5	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #6	C[Si](C)(C)OC[C@@]1(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](COP(=O)(O)O)[C@@H](O)[C@@H]1O[Si](C)(C)C	2555.1	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #6	C[Si](C)(C)OC[C@@]1(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](COP(=O)(O)O)[C@@H](O)[C@@H]1O[Si](C)(C)C	3504.3	Standard polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #7	C[Si](C)(C)OC[C@@]1(OP(=O)(O)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	2601.9	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #7	C[Si](C)(C)OC[C@@]1(OP(=O)(O)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	2500.2	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #7	C[Si](C)(C)OC[C@@]1(OP(=O)(O)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	3482.8	Standard polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #8	C[Si](C)(C)OC[C@@]1(OP(=O)(O)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	2606.0	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #8	C[Si](C)(C)OC[C@@]1(OP(=O)(O)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	2518.9	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #8	C[Si](C)(C)OC[C@@]1(OP(=O)(O)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	3435.0	Standard polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #9	C[Si](C)(C)OC[C@@]1(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](COP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@@H]1O	2583.9	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #9	C[Si](C)(C)OC[C@@]1(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](COP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@@H]1O	2568.5	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TMS,isomer #9	C[Si](C)(C)OC[C@@]1(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](COP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@@H]1O	3416.0	Standard polar	33892256
D-Fructose 2,6-bisphosphate,5TMS,isomer #1	C[Si](C)(C)OC[C@@]1(OP(=O)(O[Si](C)(C)C)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	2524.8	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,5TMS,isomer #1	C[Si](C)(C)OC[C@@]1(OP(=O)(O[Si](C)(C)C)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	2494.0	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,5TMS,isomer #1	C[Si](C)(C)OC[C@@]1(OP(=O)(O[Si](C)(C)C)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	3302.6	Standard polar	33892256
D-Fructose 2,6-bisphosphate,5TMS,isomer #10	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)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	2623.0	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,5TMS,isomer #10	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)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	2488.2	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,5TMS,isomer #10	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)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	3187.9	Standard polar	33892256
D-Fructose 2,6-bisphosphate,5TMS,isomer #11	C[Si](C)(C)O[C@H]1[C@H](O)[C@](CO)(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@@H]1COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	2637.9	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,5TMS,isomer #11	C[Si](C)(C)O[C@H]1[C@H](O)[C@](CO)(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@@H]1COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	2514.2	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,5TMS,isomer #11	C[Si](C)(C)O[C@H]1[C@H](O)[C@](CO)(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@@H]1COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	3097.0	Standard polar	33892256
D-Fructose 2,6-bisphosphate,5TMS,isomer #12	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)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	2675.7	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,5TMS,isomer #12	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)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	2527.7	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,5TMS,isomer #12	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)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	3101.6	Standard polar	33892256
D-Fructose 2,6-bisphosphate,5TMS,isomer #2	C[Si](C)(C)OC[C@@]1(OP(=O)(O)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	2597.4	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,5TMS,isomer #2	C[Si](C)(C)OC[C@@]1(OP(=O)(O)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	2458.6	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,5TMS,isomer #2	C[Si](C)(C)OC[C@@]1(OP(=O)(O)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	3309.6	Standard polar	33892256
D-Fructose 2,6-bisphosphate,5TMS,isomer #3	C[Si](C)(C)OC[C@@]1(OP(=O)(O)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	2580.5	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,5TMS,isomer #3	C[Si](C)(C)OC[C@@]1(OP(=O)(O)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	2464.3	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,5TMS,isomer #3	C[Si](C)(C)OC[C@@]1(OP(=O)(O)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	3262.3	Standard polar	33892256
D-Fructose 2,6-bisphosphate,5TMS,isomer #4	C[Si](C)(C)OC[C@@]1(OP(=O)(O[Si](C)(C)C)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	2596.8	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,5TMS,isomer #4	C[Si](C)(C)OC[C@@]1(OP(=O)(O[Si](C)(C)C)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	2499.3	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,5TMS,isomer #4	C[Si](C)(C)OC[C@@]1(OP(=O)(O[Si](C)(C)C)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	3227.5	Standard polar	33892256
D-Fructose 2,6-bisphosphate,5TMS,isomer #5	C[Si](C)(C)OC[C@@]1(OP(=O)(O)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	2609.2	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,5TMS,isomer #5	C[Si](C)(C)OC[C@@]1(OP(=O)(O)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	2477.6	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,5TMS,isomer #5	C[Si](C)(C)OC[C@@]1(OP(=O)(O)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	3205.4	Standard polar	33892256
D-Fructose 2,6-bisphosphate,5TMS,isomer #6	C[Si](C)(C)OC[C@@]1(OP(=O)(O[Si](C)(C)C)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	2618.8	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,5TMS,isomer #6	C[Si](C)(C)OC[C@@]1(OP(=O)(O[Si](C)(C)C)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	2507.7	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,5TMS,isomer #6	C[Si](C)(C)OC[C@@]1(OP(=O)(O[Si](C)(C)C)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	3233.9	Standard polar	33892256
D-Fructose 2,6-bisphosphate,5TMS,isomer #7	C[Si](C)(C)OC[C@@]1(OP(=O)(O)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	2641.7	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,5TMS,isomer #7	C[Si](C)(C)OC[C@@]1(OP(=O)(O)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	2486.8	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,5TMS,isomer #7	C[Si](C)(C)OC[C@@]1(OP(=O)(O)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	3212.2	Standard polar	33892256
D-Fructose 2,6-bisphosphate,5TMS,isomer #8	C[Si](C)(C)OC[C@@]1(OP(=O)(O[Si](C)(C)C)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	2619.9	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,5TMS,isomer #8	C[Si](C)(C)OC[C@@]1(OP(=O)(O[Si](C)(C)C)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	2529.9	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,5TMS,isomer #8	C[Si](C)(C)OC[C@@]1(OP(=O)(O[Si](C)(C)C)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	3172.8	Standard polar	33892256
D-Fructose 2,6-bisphosphate,5TMS,isomer #9	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)OP(=O)(O)O[Si](C)(C)C	2643.0	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,5TMS,isomer #9	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)OP(=O)(O)O[Si](C)(C)C	2470.0	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,5TMS,isomer #9	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)OP(=O)(O)O[Si](C)(C)C	3170.6	Standard polar	33892256
D-Fructose 2,6-bisphosphate,6TMS,isomer #1	C[Si](C)(C)OC[C@@]1(OP(=O)(O[Si](C)(C)C)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	2600.6	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,6TMS,isomer #1	C[Si](C)(C)OC[C@@]1(OP(=O)(O[Si](C)(C)C)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	2494.1	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,6TMS,isomer #1	C[Si](C)(C)OC[C@@]1(OP(=O)(O[Si](C)(C)C)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	3068.0	Standard polar	33892256
D-Fructose 2,6-bisphosphate,6TMS,isomer #2	C[Si](C)(C)OC[C@@]1(OP(=O)(O)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	2612.3	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,6TMS,isomer #2	C[Si](C)(C)OC[C@@]1(OP(=O)(O)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	2476.5	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,6TMS,isomer #2	C[Si](C)(C)OC[C@@]1(OP(=O)(O)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	3058.8	Standard polar	33892256
D-Fructose 2,6-bisphosphate,6TMS,isomer #3	C[Si](C)(C)OC[C@@]1(OP(=O)(O[Si](C)(C)C)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	2614.8	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,6TMS,isomer #3	C[Si](C)(C)OC[C@@]1(OP(=O)(O[Si](C)(C)C)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	2492.4	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,6TMS,isomer #3	C[Si](C)(C)OC[C@@]1(OP(=O)(O[Si](C)(C)C)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	2999.0	Standard polar	33892256
D-Fructose 2,6-bisphosphate,6TMS,isomer #4	C[Si](C)(C)OC[C@@]1(OP(=O)(O[Si](C)(C)C)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	2641.9	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,6TMS,isomer #4	C[Si](C)(C)OC[C@@]1(OP(=O)(O[Si](C)(C)C)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	2502.8	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,6TMS,isomer #4	C[Si](C)(C)OC[C@@]1(OP(=O)(O[Si](C)(C)C)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	3008.5	Standard polar	33892256
D-Fructose 2,6-bisphosphate,6TMS,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)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	2650.3	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,6TMS,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)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	2491.2	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,6TMS,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)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	2958.5	Standard polar	33892256
D-Fructose 2,6-bisphosphate,7TMS,isomer #1	C[Si](C)(C)OC[C@@]1(OP(=O)(O[Si](C)(C)C)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	2654.6	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,7TMS,isomer #1	C[Si](C)(C)OC[C@@]1(OP(=O)(O[Si](C)(C)C)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	2521.9	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,7TMS,isomer #1	C[Si](C)(C)OC[C@@]1(OP(=O)(O[Si](C)(C)C)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	2912.3	Standard polar	33892256
D-Fructose 2,6-bisphosphate,1TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC[C@@]1(OP(=O)(O)O)O[C@H](COP(=O)(O)O)[C@@H](O)[C@@H]1O	2880.0	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,1TBDMS,isomer #2	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@](CO)(OP(=O)(O)O)O[C@@H]1COP(=O)(O)O	2872.5	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,1TBDMS,isomer #3	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@@H](COP(=O)(O)O)O[C@@]1(CO)OP(=O)(O)O	2897.5	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,1TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OP(=O)(O)O[C@]1(CO)O[C@H](COP(=O)(O)O)[C@@H](O)[C@@H]1O	2930.3	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,1TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OP(=O)(O)OC[C@H]1O[C@@](CO)(OP(=O)(O)O)[C@@H](O)[C@@H]1O	3019.8	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,2TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC[C@@]1(OP(=O)(O)O)O[C@H](COP(=O)(O)O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	2934.1	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,2TBDMS,isomer #10	CC(C)(C)[Si](C)(C)OP(=O)(O[C@]1(CO)O[C@H](COP(=O)(O)O)[C@@H](O)[C@@H]1O)O[Si](C)(C)C(C)(C)C	3065.8	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,2TBDMS,isomer #11	CC(C)(C)[Si](C)(C)OP(=O)(O)OC[C@H]1O[C@@](CO)(OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O	3170.7	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,2TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OP(=O)(OC[C@H]1O[C@@](CO)(OP(=O)(O)O)[C@@H](O)[C@@H]1O)O[Si](C)(C)C(C)(C)C	3170.5	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,2TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC[C@@]1(OP(=O)(O)O)O[C@H](COP(=O)(O)O)[C@@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	2942.3	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,2TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC[C@@]1(OP(=O)(O)O[Si](C)(C)C(C)(C)C)O[C@H](COP(=O)(O)O)[C@@H](O)[C@@H]1O	2999.2	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,2TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC[C@@]1(OP(=O)(O)O)O[C@H](COP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O	3075.1	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,2TBDMS,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)O)O[C@@]1(CO)OP(=O)(O)O	2972.0	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,2TBDMS,isomer #6	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@](CO)(OP(=O)(O)O[Si](C)(C)C(C)(C)C)O[C@@H]1COP(=O)(O)O	3019.6	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,2TBDMS,isomer #7	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@](CO)(OP(=O)(O)O)O[C@@H]1COP(=O)(O)O[Si](C)(C)C(C)(C)C	3096.2	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,2TBDMS,isomer #8	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)OP(=O)(O)O	3115.3	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,2TBDMS,isomer #9	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@@H](COP(=O)(O)O)O[C@@]1(CO)OP(=O)(O)O[Si](C)(C)C(C)(C)C	3045.0	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,3TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC[C@@]1(OP(=O)(O)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	3094.2	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,3TBDMS,isomer #10	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)OP(=O)(O)O[Si](C)(C)C(C)(C)C	3183.0	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,3TBDMS,isomer #11	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@](CO)(OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)O[C@@H]1COP(=O)(O)O	3179.3	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,3TBDMS,isomer #12	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@](CO)(OP(=O)(O)O[Si](C)(C)C(C)(C)C)O[C@@H]1COP(=O)(O)O[Si](C)(C)C(C)(C)C	3249.5	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,3TBDMS,isomer #13	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@](CO)(OP(=O)(O)O)O[C@@H]1COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	3258.3	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,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(CO)OP(=O)(O)O	3282.4	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,3TBDMS,isomer #15	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)OP(=O)(O)O[Si](C)(C)C(C)(C)C	3272.8	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,3TBDMS,isomer #16	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@@H](COP(=O)(O)O)O[C@@]1(CO)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	3209.1	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,3TBDMS,isomer #17	CC(C)(C)[Si](C)(C)OP(=O)(O)OC[C@H]1O[C@@](CO)(OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O	3278.6	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,3TBDMS,isomer #18	CC(C)(C)[Si](C)(C)OP(=O)(O)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	3315.0	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,3TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC[C@@]1(OP(=O)(O)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	3120.9	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,3TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC[C@@]1(OP(=O)(O)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	3177.7	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,3TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC[C@@]1(OP(=O)(O)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	3133.9	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,3TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC[C@@]1(OP(=O)(O)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	3188.8	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,3TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC[C@@]1(OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)O[C@H](COP(=O)(O)O)[C@@H](O)[C@@H]1O	3137.9	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,3TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC[C@@]1(OP(=O)(O)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	3218.2	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,3TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OC[C@@]1(OP(=O)(O)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	3226.9	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,3TBDMS,isomer #9	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)OP(=O)(O)O	3229.4	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC[C@@]1(OP(=O)(O)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	3324.2	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC[C@@]1(OP(=O)(O)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	3186.6	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC[C@@]1(OP(=O)(O)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	3787.9	Standard polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #10	CC(C)(C)[Si](C)(C)OC[C@@]1(OP(=O)(O)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	3399.4	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #10	CC(C)(C)[Si](C)(C)OC[C@@]1(OP(=O)(O)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	3186.2	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #10	CC(C)(C)[Si](C)(C)OC[C@@]1(OP(=O)(O)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	3648.2	Standard polar	33892256
D-Fructose 2,6-bisphosphate,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(CO)OP(=O)(O)O	3412.7	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,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(CO)OP(=O)(O)O	3175.1	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,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(CO)OP(=O)(O)O	3635.3	Standard polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,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(CO)OP(=O)(O)O[Si](C)(C)C(C)(C)C	3405.2	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,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(CO)OP(=O)(O)O[Si](C)(C)C(C)(C)C	3170.6	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,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(CO)OP(=O)(O)O[Si](C)(C)C(C)(C)C	3648.6	Standard polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #13	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)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	3356.9	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #13	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)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	3186.0	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #13	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)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	3679.9	Standard polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #14	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@](CO)(OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)O[C@@H]1COP(=O)(O)O[Si](C)(C)C(C)(C)C	3398.1	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #14	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@](CO)(OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)O[C@@H]1COP(=O)(O)O[Si](C)(C)C(C)(C)C	3187.0	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #14	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@](CO)(OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)O[C@@H]1COP(=O)(O)O[Si](C)(C)C(C)(C)C	3592.2	Standard polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #15	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@](CO)(OP(=O)(O)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	3418.5	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #15	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@](CO)(OP(=O)(O)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	3167.7	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #15	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@](CO)(OP(=O)(O)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	3577.1	Standard polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #16	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)OP(=O)(O)O[Si](C)(C)C(C)(C)C	3447.8	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #16	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)OP(=O)(O)O[Si](C)(C)C(C)(C)C	3181.4	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #16	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)OP(=O)(O)O[Si](C)(C)C(C)(C)C	3578.8	Standard polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #17	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)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	3422.8	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #17	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)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	3200.7	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #17	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)OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	3592.7	Standard polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #18	CC(C)(C)[Si](C)(C)OP(=O)(OC[C@H]1O[C@@](CO)(OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O)O[Si](C)(C)C(C)(C)C	3445.3	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #18	CC(C)(C)[Si](C)(C)OP(=O)(OC[C@H]1O[C@@](CO)(OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O)O[Si](C)(C)C(C)(C)C	3195.4	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #18	CC(C)(C)[Si](C)(C)OP(=O)(OC[C@H]1O[C@@](CO)(OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O)O[Si](C)(C)C(C)(C)C	3550.9	Standard polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC[C@@]1(OP(=O)(O)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	3365.8	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC[C@@]1(OP(=O)(O)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	3194.6	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC[C@@]1(OP(=O)(O)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	3753.7	Standard polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC[C@@]1(OP(=O)(O[Si](C)(C)C(C)(C)C)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	3306.1	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC[C@@]1(OP(=O)(O[Si](C)(C)C(C)(C)C)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	3203.7	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC[C@@]1(OP(=O)(O[Si](C)(C)C(C)(C)C)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	3726.1	Standard polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC[C@@]1(OP(=O)(O)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	3370.4	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC[C@@]1(OP(=O)(O)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	3181.7	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC[C@@]1(OP(=O)(O)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	3688.4	Standard polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC[C@@]1(OP(=O)(O)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	3381.7	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC[C@@]1(OP(=O)(O)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	3187.7	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC[C@@]1(OP(=O)(O)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	3673.2	Standard polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC[C@@]1(OP(=O)(O[Si](C)(C)C(C)(C)C)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	3318.9	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC[C@@]1(OP(=O)(O[Si](C)(C)C(C)(C)C)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	3214.9	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC[C@@]1(OP(=O)(O[Si](C)(C)C(C)(C)C)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	3729.8	Standard polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC[C@@]1(OP(=O)(O)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	3387.2	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC[C@@]1(OP(=O)(O)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	3200.6	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC[C@@]1(OP(=O)(O)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	3690.6	Standard polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OC[C@@]1(OP(=O)(O)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	3395.3	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OC[C@@]1(OP(=O)(O)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	3203.0	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OC[C@@]1(OP(=O)(O)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	3677.5	Standard polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OC[C@@]1(OP(=O)(O[Si](C)(C)C(C)(C)C)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	3378.4	Semi standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OC[C@@]1(OP(=O)(O[Si](C)(C)C(C)(C)C)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	3206.3	Standard non polar	33892256
D-Fructose 2,6-bisphosphate,4TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OC[C@@]1(OP(=O)(O[Si](C)(C)C(C)(C)C)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	3663.3	Standard polar	33892256

Spectra

GC-MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Experimental GC-MS	GC-MS Spectrum - D-Fructose 2,6-bisphosphate GC-EI-TOF (Non-derivatized)	splash10-01dj-0963000000-090736f476a618727455	2017-09-12	HMDB team, MONA, MassBank	View Spectrum
Experimental GC-MS	GC-MS Spectrum - D-Fructose 2,6-bisphosphate GC-EI-TOF (Non-derivatized)	splash10-00tb-0972000000-e47c74a14376eaabd8c3	2017-09-12	HMDB team, MONA, MassBank	View Spectrum
Experimental GC-MS	GC-MS Spectrum - D-Fructose 2,6-bisphosphate GC-EI-TOF (Non-derivatized)	splash10-01dj-0963000000-090736f476a618727455	2018-05-18	HMDB team, MONA, MassBank	View Spectrum
Experimental GC-MS	GC-MS Spectrum - D-Fructose 2,6-bisphosphate GC-EI-TOF (Non-derivatized)	splash10-00tb-0972000000-e47c74a14376eaabd8c3	2018-05-18	HMDB team, MONA, MassBank	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - D-Fructose 2,6-bisphosphate GC-MS (Non-derivatized) - 70eV, Positive	splash10-0002-9512000000-82418e0e398490357c5e	2016-09-22	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - D-Fructose 2,6-bisphosphate GC-MS (3 TMS) - 70eV, Positive	splash10-0006-2190010000-53cf738181713979e181	2017-10-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - D-Fructose 2,6-bisphosphate 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 - D-Fructose 2,6-bisphosphate LC-ESI-QQ 10V, negative-QTOF	splash10-000i-0019000000-7b58b1d6169f22e732a8	2020-07-21	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - D-Fructose 2,6-bisphosphate LC-ESI-QQ 20V, negative-QTOF	splash10-000m-2496000000-40ad2c4944ae5c0701f3	2020-07-21	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - D-Fructose 2,6-bisphosphate LC-ESI-QQ 30V, negative-QTOF	splash10-0002-9830000000-a9cbb8a3dba391a8858b	2020-07-21	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - D-Fructose 2,6-bisphosphate LC-ESI-QQ 40V, negative-QTOF	splash10-002b-9200000000-6dcaff4e5eee3799656f	2020-07-21	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - D-Fructose 2,6-bisphosphate LC-ESI-QQ 50V, negative-QTOF	splash10-004j-9100000000-9851b59e56acb7c5802c	2020-07-21	HMDB team, MONA	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - D-Fructose 2,6-bisphosphate 10V, Negative-QTOF	splash10-002r-7409000000-0240bd8771cde252759c	2016-09-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - D-Fructose 2,6-bisphosphate 20V, Negative-QTOF	splash10-004i-9000000000-8930f98e412f1b68e30b	2016-09-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - D-Fructose 2,6-bisphosphate 40V, Negative-QTOF	splash10-004i-9000000000-fb204edc71835bcbaaad	2016-09-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - D-Fructose 2,6-bisphosphate 10V, Negative-QTOF	splash10-002r-9008000000-d519306c146482d051d0	2021-09-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - D-Fructose 2,6-bisphosphate 20V, Negative-QTOF	splash10-004i-9001000000-2d0e9375a49babbe9d93	2021-09-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - D-Fructose 2,6-bisphosphate 40V, Negative-QTOF	splash10-004i-9000000000-bc05f33d90e2bf18235c	2021-09-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - D-Fructose 2,6-bisphosphate 10V, Positive-QTOF	splash10-0006-3797000000-cb11e27ce8d0be902a39	2016-09-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - D-Fructose 2,6-bisphosphate 20V, Positive-QTOF	splash10-0002-9132000000-b908246df46f54e31180	2016-09-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - D-Fructose 2,6-bisphosphate 40V, Positive-QTOF	splash10-00dm-9600000000-19262e5981934144e1aa	2016-09-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - D-Fructose 2,6-bisphosphate 10V, Positive-QTOF	splash10-0006-0393000000-f7f716e45f745f0bec68	2021-09-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - D-Fructose 2,6-bisphosphate 20V, Positive-QTOF	splash10-0002-1920000000-f0eccbb835449758a67c	2021-09-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - D-Fructose 2,6-bisphosphate 40V, Positive-QTOF	splash10-0f6t-9410000000-f9f76bd919e86701aaff	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)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum

Biological Properties

Cellular Locations

Cytoplasm (predicted from logP)

Biospecimen Locations

Not Available

Tissue Locations

Not Available

Pathways

Name	SMPDB/PathBank	KEGG
Fructose and mannose metabolism	Not Available
Fructosuria		Not Available
Fructose intolerance, hereditary		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

BiGG ID

Wikipedia Link

Fructose_2,6-bisphosphate

METLIN ID

5964

PubChem Compound

105021

PDB ID

Not Available

ChEBI ID

28602

Food Biomarker Ontology

Not Available

VMH ID

F26BP

MarkerDB ID

Not Available

Good Scents ID

Not Available

References

Synthesis Reference

Shulman, Hagit; Makarov, Carina; Ogawa, Anthony K.; Romesberg, Floyd; Keinan, Ehud. Chemically Reactive Immunogens Lead to Functional Convergence of the Immune Response. Journal of the American Chemical Society (2000), 122(44), 10743-10753.

Material Safety Data Sheet (MSDS)

Not Available

General References

Not Available

Enzymes

Enzyme Details

1. 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 → Fructose 6-phosphate + Phosphate	details
Adenosine triphosphate + Fructose 6-phosphate → ADP + D-Fructose 2,6-bisphosphate	details
D-Fructose 2,6-bisphosphate + Water → Beta-D-Fructose 6-phosphate + Phosphate	details

Enzyme Details

2. 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

Reactions

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

Enzyme Details

3. 6-phosphofructo-2-kinase/fructose-2,6-bisphosphatase 1

General function:: Involved in catalytic activity
Specific function:: Synthesis and degradation of fructose 2,6-bisphosphate.
Gene Name:: PFKFB1
Uniprot ID:: P16118
Molecular weight:: 54680.86

Reactions

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

Enzyme Details

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

General function:: Involved in catalytic activity
Specific function:: Synthesis and degradation of fructose 2,6-bisphosphate.
Gene Name:: PFKFB2
Uniprot ID:: O60825
Molecular weight:: 54405.88

Reactions

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

Enzyme Details

5. Fructose-2,6-bisphosphatase TIGAR

General function:: Not Available
Specific function:: Fructose-bisphosphatase hydrolyzing fructose-2,6-bisphosphate as well as fructose-1,6-bisphosphate. Inhibits glycolysis by reducing cellular levels of fructose-2,6-bisphosphate. May protect cells against reactive oxygen species and against apoptosis induced by tp53.
Gene Name:: TIGAR
Uniprot ID:: Q9NQ88
Molecular weight:: 30062.295

Reactions

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

Showing metabocard for D-Fructose 2,6-bisphosphate (HMDB0001047)

MOL for HMDB0001047 (D-Fructose 2,6-bisphosphate)

3D MOL for HMDB0001047 (D-Fructose 2,6-bisphosphate)

3D SDF for HMDB0001047 (D-Fructose 2,6-bisphosphate)

3D-SDF for HMDB0001047 (D-Fructose 2,6-bisphosphate)

PDB for HMDB0001047 (D-Fructose 2,6-bisphosphate)

3D PDB for HMDB0001047 (D-Fructose 2,6-bisphosphate)

SMILES for HMDB0001047 (D-Fructose 2,6-bisphosphate)

INCHI for HMDB0001047 (D-Fructose 2,6-bisphosphate)

Structure for HMDB0001047 (D-Fructose 2,6-bisphosphate)

3D Structure for HMDB0001047 (D-Fructose 2,6-bisphosphate)

Predicted Collision Cross Sections

Predicted Kovats Retention Indices

Underivatized

Derivatized

GC-MS Spectra

MS/MS Spectra

NMR Spectra

Enzymes

Reactions

Reactions

Reactions

Reactions

Reactions