Jump To Section:

Identification Taxonomy Ontology Physical properties Spectra Biological properties Concentrations Links References enzymes (20) Show 20 proteins XML

Record Information

Version

5.0

Status

Detected and Quantified

Creation Date

2005-11-16 15:48:42 UTC

Update Date

2021-09-14 15:38:58 UTC

HMDB ID

HMDB0001401

Secondary Accession Numbers

HMDB0001549
HMDB0006793
HMDB01401
HMDB01549
HMDB06793

Metabolite Identification

Common Name

Glucose 6-phosphate

Description

Glucose 6-phosphate (G6P, sometimes called the Robison ester) is a glucose sugar phosphorylated at the hydroxy group on carbon 6. Glucose 6-phosphate (G6P) has two anomers: the alpha anomer and the beta anomer. Glucose 6-phosphate is an ester of glucose with phosphoric acid, made in the course of glucose metabolism by mammalian and other cells. It is a normal constituent of resting muscle and probably is in constant equilibrium with fructose 6-phosphate (Stedman, 26th ed). When glucose enters a cell, it is immediately phosphorylated to G6P. This is catalyzed with hexokinase enzymes, thus consuming one ATP. A major reason for immediate phosphorylation of the glucose is so that it cannot diffuse out of the cell. The phosphorylation adds a charged group so the G6P cannot easily cross cell membranes. G6P can travel down two metabolic pathways: glycolysis and the pentose phosphate pathway. In addition to the metabolic pathways, G6P can also be stored as glycogen in the liver if blood glucose levels are high. If the body needs energy or carbon skeletons for syntheses, G6P can be isomerized to fructose 6-phosphate and then phosphorylated to fructose 1,6-bisphosphate. Note, the molecule now has 2 phosphoryl groups attached. The addition of the 2nd phosphoryl group is an irreversible step, so once this happens G6P will enter glycolysis and be turned into pyruvate (ATP production occurs). If blood glucose levels are high, the body needs a way to store the excess glucose. After being converted to G6P, phosphoglucose mutase (an isomerase) can turn the molecule into glucose 1-phosphate. Glucose 1-phosphate can then be combined with uridine triphosphate (UTP) to form UDP-glucose. This reaction is driven by the hydrolysis of pyrophosphate that is released in the reaction. Now, the activated UDP-glucose can add to a growing glycogen molecule with the help of glycogen synthase. This is a very efficient storage mechanism for glucose since it costs the body only 1 ATP to store the 1 glucose molecule and virtually no energy to remove it from storage. It is important to note that glucose 6-phosphate is an allosteric activator of glycogen synthase, which makes sense because when the level of glucose is high the body should store the excess glucose as glycogen. On the other hand, glycogen synthase is inhibited when it is phosphorylated by protein kinase during times of high stress or low blood glucose levels.

Structure

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

HMDB0001401
     RDKit          3D
Glucose 6-phosphate
 29 29  0  0  0  0  0  0  0  0999 V2000
    4.7621   -0.8900   -1.2314 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7664   -0.5530   -0.1389 P   0  0  0  0  0  5  0  0  0  0  0  0
    3.5887    1.1337   -0.0092 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2449   -1.1940    1.3564 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2442   -1.2043   -0.5292 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3219   -0.5737    0.2921 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1185   -0.0543   -0.4876 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.6994   -1.1139   -0.8297 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0091   -0.7023   -1.0865 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0752    0.3912   -1.9324 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6382   -0.4421    0.2649 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.9015    0.1105    0.1409 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7559    0.4130    1.1214 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.2828   -0.3243    2.2103 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5554    0.9618    0.4031 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.8594    2.1059   -0.3521 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5793    1.3914    0.9481 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2273   -1.0770    1.4811 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9171   -1.2361    1.0826 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7511    0.3310    0.7934 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4487    0.4088   -1.4519 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5713   -1.5202   -1.5630 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9345    0.8575   -1.7596 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7587   -1.4466    0.7437 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0866    0.6124    0.9679 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3191    1.2636    1.5367 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6149   -1.2536    2.2154 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1425    1.3274    1.1990 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0509    2.2770   -0.9155 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
  9 11  1  0
 11 12  1  0
 11 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
  9 22  1  0
 10 23  1  0
 11 24  1  1
 12 25  1  0
 13 26  1  1
 14 27  1  0
 15 28  1  1
 16 29  1  0
M  END


  Mrv1652309042000222D          

 16 16  0  0  1  0            999 V2000
   -1.8588    1.2102    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0330    1.2102    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6845    1.2162    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8708    0.3904    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8708    2.0359    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7116    0.4564    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1381   -0.0030    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.1472   -0.8198    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.8498    0.4144    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8648   -1.2281    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.5555   -1.2432    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5705    0.0120    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.5764   -0.8107    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.8708   -2.0509    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2791    0.4294    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2942   -1.2191    0.0000 O   0  0  0  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  5  2  0  0  0  0
  2  6  1  0  0  0  0
  7  6  1  1  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
  8 10  1  0  0  0  0
  8 11  1  6  0  0  0
  9 12  1  0  0  0  0
 10 13  1  0  0  0  0
 10 14  1  1  0  0  0
 12 15  1  4  0  0  0
 13 16  1  6  0  0  0
 12 13  1  0  0  0  0
M  END
> <DATABASE_ID>
HMDB0001401

> <DATABASE_NAME>
hmdb

> <SMILES>
OC1O[C@H](COP(O)(O)=O)[C@@H](O)[C@H](O)[C@H]1O

> <INCHI_IDENTIFIER>
InChI=1S/C6H13O9P/c7-3-2(1-14-16(11,12)13)15-6(10)5(9)4(3)8/h2-10H,1H2,(H2,11,12,13)/t2-,3-,4+,5-,6?/m1/s1

> <INCHI_KEY>
NBSCHQHZLSJFNQ-GASJEMHNSA-N

> <FORMULA>
C6H13O9P

> <MOLECULAR_WEIGHT>
260.1358

> <EXACT_MASS>
260.029718526

> <JCHEM_ACCEPTOR_COUNT>
8

> <JCHEM_ATOM_COUNT>
29

> <JCHEM_AVERAGE_POLARIZABILITY>
21.0042642444784

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
6

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
{[(2R,3S,4S,5R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy}phosphonic acid

> <ALOGPS_LOGP>
-2.06

> <JCHEM_LOGP>
-3.056105249333333

> <ALOGPS_LOGS>
-0.92

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
1

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-2

> <JCHEM_PKA>
6.248752256962443

> <JCHEM_PKA_STRONGEST_ACIDIC>
1.222936327751123

> <JCHEM_PKA_STRONGEST_BASIC>
-3.64935696086094

> <JCHEM_POLAR_SURFACE_AREA>
156.91

> <JCHEM_REFRACTIVITY>
46.796299999999995

> <JCHEM_ROTATABLE_BOND_COUNT>
3

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
3.14e+01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
glucose 6-phosphate

> <JCHEM_VEBER_RULE>
0

$$$$

HMDB0001401
     RDKit          3D
Glucose 6-phosphate
 29 29  0  0  0  0  0  0  0  0999 V2000
    4.7621   -0.8900   -1.2314 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7664   -0.5530   -0.1389 P   0  0  0  0  0  5  0  0  0  0  0  0
    3.5887    1.1337   -0.0092 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2449   -1.1940    1.3564 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2442   -1.2043   -0.5292 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3219   -0.5737    0.2921 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1185   -0.0543   -0.4876 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.6994   -1.1139   -0.8297 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0091   -0.7023   -1.0865 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0752    0.3912   -1.9324 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6382   -0.4421    0.2649 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.9015    0.1105    0.1409 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7559    0.4130    1.1214 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.2828   -0.3243    2.2103 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5554    0.9618    0.4031 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.8594    2.1059   -0.3521 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5793    1.3914    0.9481 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2273   -1.0770    1.4811 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9171   -1.2361    1.0826 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7511    0.3310    0.7934 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4487    0.4088   -1.4519 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5713   -1.5202   -1.5630 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9345    0.8575   -1.7596 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7587   -1.4466    0.7437 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0866    0.6124    0.9679 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3191    1.2636    1.5367 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6149   -1.2536    2.2154 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1425    1.3274    1.1990 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0509    2.2770   -0.9155 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
  9 11  1  0
 11 12  1  0
 11 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
  9 22  1  0
 10 23  1  0
 11 24  1  1
 12 25  1  0
 13 26  1  1
 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      -3.470   2.259   0.000  0.00  0.00           P+0
HETATM    2  O   UNK     0      -1.928   2.259   0.000  0.00  0.00           O+0
HETATM    3  O   UNK     0      -5.011   2.270   0.000  0.00  0.00           O+0
HETATM    4  O   UNK     0      -3.492   0.729   0.000  0.00  0.00           O+0
HETATM    5  O   UNK     0      -3.492   3.800   0.000  0.00  0.00           O+0
HETATM    6  C   UNK     0      -1.328   0.852   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       0.258  -0.006   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       0.275  -1.530   0.000  0.00  0.00           C+0
HETATM    9  O   UNK     0       1.586   0.774   0.000  0.00  0.00           O+0
HETATM   10  C   UNK     0       1.614  -2.292   0.000  0.00  0.00           C+0
HETATM   11  O   UNK     0      -1.037  -2.321   0.000  0.00  0.00           O+0
HETATM   12  C   UNK     0       2.932   0.022   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0       2.943  -1.513   0.000  0.00  0.00           C+0
HETATM   14  O   UNK     0       1.625  -3.828   0.000  0.00  0.00           O+0
HETATM   15  O   UNK     0       4.254   0.802   0.000  0.00  0.00           O+0
HETATM   16  O   UNK     0       4.283  -2.276   0.000  0.00  0.00           O+0
CONECT    1    2    3    4    5                                             
CONECT    2    1    6                                                       
CONECT    3    1                                                            
CONECT    4    1                                                            
CONECT    5    1                                                            
CONECT    6    2    7                                                       
CONECT    7    6    8    9                                                  
CONECT    8    7   10   11                                                  
CONECT    9    7   12                                                       
CONECT   10    8   13   14                                                  
CONECT   11    8                                                            
CONECT   12    9   15   13                                                  
CONECT   13   10   16   12                                                  
CONECT   14   10                                                            
CONECT   15   12                                                            
CONECT   16   13                                                            
MASTER        0    0    0    0    0    0    0    0   16    0   32    0
END

COMPND    HMDB0001401
HETATM    1  O1  UNL     1       4.762  -0.890  -1.231  1.00  0.00           O  
HETATM    2  P1  UNL     1       3.766  -0.553  -0.139  1.00  0.00           P  
HETATM    3  O2  UNL     1       3.589   1.134  -0.009  1.00  0.00           O  
HETATM    4  O3  UNL     1       4.245  -1.194   1.356  1.00  0.00           O  
HETATM    5  O4  UNL     1       2.244  -1.204  -0.529  1.00  0.00           O  
HETATM    6  C1  UNL     1       1.322  -0.574   0.292  1.00  0.00           C  
HETATM    7  C2  UNL     1       0.118  -0.054  -0.488  1.00  0.00           C  
HETATM    8  O5  UNL     1      -0.699  -1.114  -0.830  1.00  0.00           O  
HETATM    9  C3  UNL     1      -2.009  -0.702  -1.086  1.00  0.00           C  
HETATM   10  O6  UNL     1      -2.075   0.391  -1.932  1.00  0.00           O  
HETATM   11  C4  UNL     1      -2.638  -0.442   0.265  1.00  0.00           C  
HETATM   12  O7  UNL     1      -3.901   0.110   0.141  1.00  0.00           O  
HETATM   13  C5  UNL     1      -1.756   0.413   1.121  1.00  0.00           C  
HETATM   14  O8  UNL     1      -1.283  -0.324   2.210  1.00  0.00           O  
HETATM   15  C6  UNL     1      -0.555   0.962   0.403  1.00  0.00           C  
HETATM   16  O9  UNL     1      -0.859   2.106  -0.352  1.00  0.00           O  
HETATM   17  H1  UNL     1       3.579   1.391   0.948  1.00  0.00           H  
HETATM   18  H2  UNL     1       5.227  -1.077   1.481  1.00  0.00           H  
HETATM   19  H3  UNL     1       0.917  -1.236   1.083  1.00  0.00           H  
HETATM   20  H4  UNL     1       1.751   0.331   0.793  1.00  0.00           H  
HETATM   21  H5  UNL     1       0.449   0.409  -1.452  1.00  0.00           H  
HETATM   22  H6  UNL     1      -2.571  -1.520  -1.563  1.00  0.00           H  
HETATM   23  H7  UNL     1      -2.934   0.857  -1.760  1.00  0.00           H  
HETATM   24  H8  UNL     1      -2.759  -1.447   0.744  1.00  0.00           H  
HETATM   25  H9  UNL     1      -4.087   0.612   0.968  1.00  0.00           H  
HETATM   26  H10 UNL     1      -2.319   1.264   1.537  1.00  0.00           H  
HETATM   27  H11 UNL     1      -1.615  -1.254   2.215  1.00  0.00           H  
HETATM   28  H12 UNL     1       0.142   1.327   1.199  1.00  0.00           H  
HETATM   29  H13 UNL     1      -0.051   2.277  -0.916  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   22
CONECT   10   23
CONECT   11   12   13   24
CONECT   12   25
CONECT   13   14   15   26
CONECT   14   27
CONECT   15   16   28
CONECT   16   29
END

HMDB0001401
     RDKit          3D
Glucose 6-phosphate
 29 29  0  0  0  0  0  0  0  0999 V2000
    4.7621   -0.8900   -1.2314 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7664   -0.5530   -0.1389 P   0  0  0  0  0  5  0  0  0  0  0  0
    3.5887    1.1337   -0.0092 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2449   -1.1940    1.3564 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2442   -1.2043   -0.5292 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3219   -0.5737    0.2921 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1185   -0.0543   -0.4876 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.6994   -1.1139   -0.8297 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0091   -0.7023   -1.0865 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0752    0.3912   -1.9324 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6382   -0.4421    0.2649 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.9015    0.1105    0.1409 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7559    0.4130    1.1214 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.2828   -0.3243    2.2103 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5554    0.9618    0.4031 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.8594    2.1059   -0.3521 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5793    1.3914    0.9481 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2273   -1.0770    1.4811 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9171   -1.2361    1.0826 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7511    0.3310    0.7934 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4487    0.4088   -1.4519 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5713   -1.5202   -1.5630 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9345    0.8575   -1.7596 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7587   -1.4466    0.7437 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0866    0.6124    0.9679 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3191    1.2636    1.5367 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6149   -1.2536    2.2154 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1425    1.3274    1.1990 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0509    2.2770   -0.9155 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
  9 11  1  0
 11 12  1  0
 11 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
  9 22  1  0
 10 23  1  0
 11 24  1  1
 12 25  1  0
 13 26  1  1
 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-D-glucopyranose	ChEBI
D-Glucose 6-phosphate	ChEBI
GLC6p	ChEBI
Robison ester	ChEBI
D-Glucose 6-phosphoric acid	Generator
Glucose 6-phosphoric acid	Generator
a-D-Glucose 6- phosphate	HMDB
alpha-D-Glucose 6- phosphate	HMDB
alpha-D-Glucose 6-phosphate	HMDB
alpha-D-Hexose 6-phosphate	HMDB
D(+)-Glucopyranose 6-phosphate	HMDB
D-Glucose-6-dihydrogen phosphate	HMDB
D-Hexose 6-phosphate	HMDB
Glucose-6-phosphate	HMDB
Glucose 6-phosphate	KEGG
D-Glucopyranose 6-phosphoric acid	Generator

Chemical Formula

C₆H₁₃O₉P

Average Molecular Weight

260.1358

Monoisotopic Molecular Weight

260.029718526

IUPAC Name

{[(2R,3S,4S,5R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy}phosphonic acid

Traditional Name

glucose 6-phosphate

CAS Registry Number

56-73-5

SMILES

OC1O[C@H](COP(O)(O)=O)[C@@H](O)[C@H](O)[C@H]1O

InChI Identifier

InChI=1S/C6H13O9P/c7-3-2(1-14-16(11,12)13)15-6(10)5(9)4(3)8/h2-10H,1H2,(H2,11,12,13)/t2-,3-,4+,5-,6?/m1/s1

InChI Key

NBSCHQHZLSJFNQ-GASJEMHNSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as hexose phosphates. These are carbohydrate derivatives containing a hexose 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

Hexose phosphates

Alternative Parents

Substituents

Hexose phosphate
Monosaccharide phosphate
Monoalkyl phosphate
Organic phosphoric acid derivative
Alkyl phosphate
Oxane
Phosphoric acid ester
Hemiacetal
Secondary alcohol
Oxacycle
Organoheterocyclic compound
Polyol
Hydrocarbon derivative
Alcohol
Organic oxide
Aliphatic heteromonocyclic compound

Molecular Framework

Aliphatic heteromonocyclic compounds

External Descriptors

D-hexopyranose 6-phosphate (CHEBI:4170 )
D-glucose 6-phosphate (CHEBI:4170 )

Ontology

Not Available

Adrenal Gland (HMDB: HMDB0001401)

Biofluid or Excreta

Non-excretory biofluid

Excreta

Urine (PMID: 32966057)
Feces (PMID: 25037050)

Cellular substructure

Organelle

Endoplasmic reticulum (HMDB: HMDB0001401)

Tissue

Connective tissue

Adipose Tissue (HMDB: HMDB0001401)

Muscle tissue

Skeletal Muscle (HMDB: HMDB0001401)

Cell

Fibroblasts (HMDB: HMDB0001401)

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)
Greylag goose (FooDB: FOOD00368)
Guinea hen (FooDB: FOOD00373)
Ostrich (FooDB: FOOD00422)
Velvet duck (FooDB: FOOD00427)

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)

Equine

Horse (FooDB: FOOD00378)

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)

Milk and milk product

Unfermented milk

Milk (Cow) (FooDB: FOOD00618)

Process

Naturally occurring process

Biological process

Biochemical pathway

Metabolic pathway

Gluconeogenesis (HMDB: HMDB0001401)
Inositol Metabolism (HMDB: HMDB0001401)
Nucleotide Sugars Metabolism (HMDB: HMDB0001401)
Pentose Phosphate Pathway (HMDB: HMDB0001401)
Starch and Sucrose Metabolism (HMDB: HMDB0001401)
Inositol Phosphate Metabolism (HMDB: HMDB0001401)
Galactose Metabolism (HMDB: HMDB0001401)
Glycolysis (HMDB: HMDB0001401)
Inositol Phosphate Metabolism (PathBank: SMP0002394)
Amino Sugar and Nucleotide Sugar Metabolism III (PathBank: SMP0121303)
Trehalose Biosynthesis I (PathBank: SMP0122252)
Trehalose Degradation I (Low Osmolarity) (PathBank: SMP0122258)
Warburg Effect (PathBank: SMP0000654)
Galactose Degradation/Leloir Pathway (PathBank: SMP0000903)
Amino Sugar and Nucleotide Sugar Metabolism II (PathBank: SMP0000906)
Colanic Acid Building Blocks Biosynthesis (PathBank: SMP0000967)
Glycolysis I (PathBank: SMP0002312)
Fructose Metabolism (PathBank: SMP0002314)
Leloir Pathway (PathBank: SMP0002319)
Ethanol Fermentation (PathBank: SMP0002356)
Starch and Sucrose Metabolism (PathBank: SMP0002380)
D-Galactose Degradation (Leloir pathway) (PathBank: SMP0012059)
Chitin Biosynthesis (PathBank: SMP0094667)

Disease pathway

Glycogenosis, Type III. Cori Disease, Debrancher Glycogenosis (PathBank: SMP0120617)
Glycogenosis, Type IV. Amylopectinosis, Anderson Disease (PathBank: SMP0120618)
Glycogenosis, Type VI. Hers Disease (PathBank: SMP0120619)
Mucopolysaccharidosis VII. Sly Syndrome (PathBank: SMP0120620)
Sucrase-Isomaltase Deficiency (PathBank: SMP0120621)
Phosphoenolpyruvate Carboxykinase Deficiency 1 (PEPCK1) (PathBank: SMP0120624)
Fructose-1,6-diphosphatase Deficiency (PathBank: SMP0120626)
Triosephosphate Isomerase Deficiency (PathBank: SMP0120627)
Fanconi-Bickel Syndrome (PathBank: SMP0120636)
Glycogenosis, Type IB (PathBank: SMP0120637)
Glycogenosis, Type IC (PathBank: SMP0120638)
Glycogenosis, Type IA. Von Gierke Disease (PathBank: SMP0120645)
Galactosemia (PathBank: SMP0120699)
Glycogen Storage Disease Type 1A (GSD1A) or Von Gierke Disease (PathBank: SMP0120708)
Galactosemia II (GALK) (PathBank: SMP0120780)
Galactosemia III (PathBank: SMP0120781)
Glucose-6-phosphate Dehydrogenase Deficiency (PathBank: SMP0120802)
Ribose-5-phosphate Isomerase Deficiency (PathBank: SMP0120803)
Transaldolase Deficiency (PathBank: SMP0120804)
Glycogenosis, Type VII. Tarui Disease (PathBank: SMP0120815)
Glycogen Synthetase Deficiency (PathBank: SMP0120835)

Role

Industrial application

Pharmaceutical industry

Biomarker

Alzheimer's Disease (MarkerDB: MDB00029998)

Physical Properties

State

Liquid

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]-	Astarita_neg	143.3	30932474
[M-H]-	Not Available	146.5	http://allccs.zhulab.cn/database/detail?ID=AllCCS00000421

Predicted Molecular Properties

Property	Value	Source
Water Solubility	31.4 g/L	ALOGPS
logP	-2.1	ALOGPS
logP	-3.1	ChemAxon
logS	-0.92	ALOGPS
pKa (Strongest Acidic)	1.22	ChemAxon
pKa (Strongest Basic)	-3.6	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	3	ChemAxon
Refractivity	46.8 m³·mol⁻¹	ChemAxon
Polarizability	21 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]+	160.115	31661259
DarkChem	[M-H]-	153.198	31661259
AllCCS	[M+H]+	156.316	32859911
AllCCS	[M-H]-	147.163	32859911
DeepCCS	[M+H]+	143.873	30932474
DeepCCS	[M-H]-	141.478	30932474
DeepCCS	[M-2H]-	175.88	30932474
DeepCCS	[M+Na]+	150.958	30932474
AllCCS	[M+H]+	156.3	32859911
AllCCS	[M+H-H2O]+	152.8	32859911
AllCCS	[M+NH4]+	159.6	32859911
AllCCS	[M+Na]+	160.5	32859911
AllCCS	[M-H]-	147.2	32859911
AllCCS	[M+Na-2H]-	147.5	32859911
AllCCS	[M+HCOO]-	147.9	32859911

Predicted Kovats Retention Indices

Underivatized

Metabolite	SMILES	Kovats RI Value	Column Type	Reference
Glucose 6-phosphate	OC1O[C@H](COP(O)(O)=O)[C@@H](O)[C@H](O)[C@H]1O	3460.7	Standard polar	33892256
Glucose 6-phosphate	OC1O[C@H](COP(O)(O)=O)[C@@H](O)[C@H](O)[C@H]1O	2090.2	Standard non polar	33892256
Glucose 6-phosphate	OC1O[C@H](COP(O)(O)=O)[C@@H](O)[C@H](O)[C@H]1O	2249.8	Semi standard non polar	33892256

Derivatized

Derivative Name / Structure	SMILES	Kovats RI Value	Column Type	Reference
Glucose 6-phosphate,1TMS,isomer #1	C[Si](C)(C)OC1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H](O)[C@H]1O	2152.3	Semi standard non polar	33892256
Glucose 6-phosphate,1TMS,isomer #2	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)O)OC(O)[C@H](O)[C@H]1O	2115.4	Semi standard non polar	33892256
Glucose 6-phosphate,1TMS,isomer #3	C[Si](C)(C)O[C@@H]1[C@@H](O)C(O)O[C@H](COP(=O)(O)O)[C@H]1O	2129.5	Semi standard non polar	33892256
Glucose 6-phosphate,1TMS,isomer #4	C[Si](C)(C)O[C@H]1C(O)O[C@H](COP(=O)(O)O)[C@@H](O)[C@@H]1O	2157.5	Semi standard non polar	33892256
Glucose 6-phosphate,1TMS,isomer #5	C[Si](C)(C)OP(=O)(O)OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O	2267.7	Semi standard non polar	33892256
Glucose 6-phosphate,2TMS,isomer #1	C[Si](C)(C)OC1O[C@H](COP(=O)(O)O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	2113.2	Semi standard non polar	33892256
Glucose 6-phosphate,2TMS,isomer #10	C[Si](C)(C)O[C@H]1C(O)O[C@H](COP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@@H]1O	2261.3	Semi standard non polar	33892256
Glucose 6-phosphate,2TMS,isomer #11	C[Si](C)(C)OP(=O)(OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O)O[Si](C)(C)C	2268.5	Semi standard non polar	33892256
Glucose 6-phosphate,2TMS,isomer #2	C[Si](C)(C)OC1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	2113.1	Semi standard non polar	33892256
Glucose 6-phosphate,2TMS,isomer #3	C[Si](C)(C)OC1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	2134.4	Semi standard non polar	33892256
Glucose 6-phosphate,2TMS,isomer #4	C[Si](C)(C)OC1O[C@H](COP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]1O	2242.9	Semi standard non polar	33892256
Glucose 6-phosphate,2TMS,isomer #5	C[Si](C)(C)O[C@H]1[C@H](O)[C@@H](O[Si](C)(C)C)C(O)O[C@@H]1COP(=O)(O)O	2126.0	Semi standard non polar	33892256
Glucose 6-phosphate,2TMS,isomer #6	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)O)OC(O)[C@H](O)[C@H]1O[Si](C)(C)C	2081.9	Semi standard non polar	33892256
Glucose 6-phosphate,2TMS,isomer #7	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)O[Si](C)(C)C)OC(O)[C@H](O)[C@H]1O	2205.8	Semi standard non polar	33892256
Glucose 6-phosphate,2TMS,isomer #8	C[Si](C)(C)O[C@@H]1[C@@H](O[Si](C)(C)C)C(O)O[C@H](COP(=O)(O)O)[C@H]1O	2127.9	Semi standard non polar	33892256
Glucose 6-phosphate,2TMS,isomer #9	C[Si](C)(C)O[C@@H]1[C@@H](O)C(O)O[C@H](COP(=O)(O)O[Si](C)(C)C)[C@H]1O	2225.2	Semi standard non polar	33892256
Glucose 6-phosphate,3TMS,isomer #1	C[Si](C)(C)OC1O[C@H](COP(=O)(O)O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O	2118.7	Semi standard non polar	33892256
Glucose 6-phosphate,3TMS,isomer #10	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)O[Si](C)(C)C)OC(O)[C@H](O)[C@H]1O[Si](C)(C)C	2153.4	Semi standard non polar	33892256
Glucose 6-phosphate,3TMS,isomer #11	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(O)[C@H](O)[C@H]1O	2179.1	Semi standard non polar	33892256
Glucose 6-phosphate,3TMS,isomer #12	C[Si](C)(C)O[C@@H]1[C@@H](O[Si](C)(C)C)C(O)O[C@H](COP(=O)(O)O[Si](C)(C)C)[C@H]1O	2198.6	Semi standard non polar	33892256
Glucose 6-phosphate,3TMS,isomer #13	C[Si](C)(C)O[C@@H]1[C@@H](O)C(O)O[C@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H]1O	2185.6	Semi standard non polar	33892256
Glucose 6-phosphate,3TMS,isomer #14	C[Si](C)(C)O[C@H]1C(O)O[C@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@@H]1O	2219.2	Semi standard non polar	33892256
Glucose 6-phosphate,3TMS,isomer #2	C[Si](C)(C)OC1O[C@H](COP(=O)(O)O)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C	2115.7	Semi standard non polar	33892256
Glucose 6-phosphate,3TMS,isomer #3	C[Si](C)(C)OC1O[C@H](COP(=O)(O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	2167.8	Semi standard non polar	33892256
Glucose 6-phosphate,3TMS,isomer #4	C[Si](C)(C)OC1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	2127.6	Semi standard non polar	33892256
Glucose 6-phosphate,3TMS,isomer #5	C[Si](C)(C)OC1O[C@H](COP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	2182.5	Semi standard non polar	33892256
Glucose 6-phosphate,3TMS,isomer #6	C[Si](C)(C)OC1O[C@H](COP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	2180.9	Semi standard non polar	33892256
Glucose 6-phosphate,3TMS,isomer #7	C[Si](C)(C)OC1O[C@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]1O	2177.3	Semi standard non polar	33892256
Glucose 6-phosphate,3TMS,isomer #8	C[Si](C)(C)O[C@@H]1[C@@H](O[Si](C)(C)C)C(O)O[C@H](COP(=O)(O)O)[C@H]1O[Si](C)(C)C	2137.2	Semi standard non polar	33892256
Glucose 6-phosphate,3TMS,isomer #9	C[Si](C)(C)O[C@H]1[C@H](O)[C@@H](O[Si](C)(C)C)C(O)O[C@@H]1COP(=O)(O)O[Si](C)(C)C	2200.6	Semi standard non polar	33892256
Glucose 6-phosphate,4TMS,isomer #1	C[Si](C)(C)OC1O[C@H](COP(=O)(O)O)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	2149.6	Semi standard non polar	33892256
Glucose 6-phosphate,4TMS,isomer #10	C[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(O)[C@H](O)[C@H]1O[Si](C)(C)C	2211.6	Semi standard non polar	33892256
Glucose 6-phosphate,4TMS,isomer #11	C[Si](C)(C)O[C@@H]1[C@@H](O[Si](C)(C)C)C(O)O[C@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H]1O	2253.7	Semi standard non polar	33892256
Glucose 6-phosphate,4TMS,isomer #2	C[Si](C)(C)OC1O[C@H](COP(=O)(O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O	2203.2	Semi standard non polar	33892256
Glucose 6-phosphate,4TMS,isomer #3	C[Si](C)(C)OC1O[C@H](COP(=O)(O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C	2211.9	Semi standard non polar	33892256
Glucose 6-phosphate,4TMS,isomer #4	C[Si](C)(C)OC1O[C@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	2203.7	Semi standard non polar	33892256
Glucose 6-phosphate,4TMS,isomer #5	C[Si](C)(C)OC1O[C@H](COP(=O)(O)O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	2215.6	Semi standard non polar	33892256
Glucose 6-phosphate,4TMS,isomer #6	C[Si](C)(C)OC1O[C@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	2230.7	Semi standard non polar	33892256
Glucose 6-phosphate,4TMS,isomer #7	C[Si](C)(C)OC1O[C@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	2185.4	Semi standard non polar	33892256
Glucose 6-phosphate,4TMS,isomer #8	C[Si](C)(C)O[C@@H]1[C@@H](O[Si](C)(C)C)C(O)O[C@H](COP(=O)(O)O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	2237.8	Semi standard non polar	33892256
Glucose 6-phosphate,4TMS,isomer #9	C[Si](C)(C)O[C@H]1[C@H](O)[C@@H](O[Si](C)(C)C)C(O)O[C@@H]1COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	2258.2	Semi standard non polar	33892256
Glucose 6-phosphate,5TMS,isomer #1	C[Si](C)(C)OC1O[C@H](COP(=O)(O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	2236.6	Semi standard non polar	33892256
Glucose 6-phosphate,5TMS,isomer #1	C[Si](C)(C)OC1O[C@H](COP(=O)(O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	2242.3	Standard non polar	33892256
Glucose 6-phosphate,5TMS,isomer #1	C[Si](C)(C)OC1O[C@H](COP(=O)(O)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	2583.2	Standard polar	33892256
Glucose 6-phosphate,5TMS,isomer #2	C[Si](C)(C)OC1O[C@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O	2255.4	Semi standard non polar	33892256
Glucose 6-phosphate,5TMS,isomer #2	C[Si](C)(C)OC1O[C@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O	2270.8	Standard non polar	33892256
Glucose 6-phosphate,5TMS,isomer #2	C[Si](C)(C)OC1O[C@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O	2487.0	Standard polar	33892256
Glucose 6-phosphate,5TMS,isomer #3	C[Si](C)(C)OC1O[C@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C	2274.3	Semi standard non polar	33892256
Glucose 6-phosphate,5TMS,isomer #3	C[Si](C)(C)OC1O[C@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C	2293.5	Standard non polar	33892256
Glucose 6-phosphate,5TMS,isomer #3	C[Si](C)(C)OC1O[C@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C	2538.7	Standard polar	33892256
Glucose 6-phosphate,5TMS,isomer #4	C[Si](C)(C)OC1O[C@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	2268.9	Semi standard non polar	33892256
Glucose 6-phosphate,5TMS,isomer #4	C[Si](C)(C)OC1O[C@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	2268.7	Standard non polar	33892256
Glucose 6-phosphate,5TMS,isomer #4	C[Si](C)(C)OC1O[C@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	2499.5	Standard polar	33892256
Glucose 6-phosphate,5TMS,isomer #5	C[Si](C)(C)O[C@@H]1[C@@H](O[Si](C)(C)C)C(O)O[C@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	2277.1	Semi standard non polar	33892256
Glucose 6-phosphate,5TMS,isomer #5	C[Si](C)(C)O[C@@H]1[C@@H](O[Si](C)(C)C)C(O)O[C@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	2267.0	Standard non polar	33892256
Glucose 6-phosphate,5TMS,isomer #5	C[Si](C)(C)O[C@@H]1[C@@H](O[Si](C)(C)C)C(O)O[C@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	2462.1	Standard polar	33892256
Glucose 6-phosphate,6TMS,isomer #1	C[Si](C)(C)OC1O[C@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	2288.9	Semi standard non polar	33892256
Glucose 6-phosphate,6TMS,isomer #1	C[Si](C)(C)OC1O[C@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	2293.9	Standard non polar	33892256
Glucose 6-phosphate,6TMS,isomer #1	C[Si](C)(C)OC1O[C@H](COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	2407.7	Standard polar	33892256
Glucose 6-phosphate,1TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H](O)[C@H]1O	2395.5	Semi standard non polar	33892256
Glucose 6-phosphate,1TBDMS,isomer #2	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)O)OC(O)[C@H](O)[C@H]1O	2398.4	Semi standard non polar	33892256
Glucose 6-phosphate,1TBDMS,isomer #3	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](O)C(O)O[C@H](COP(=O)(O)O)[C@H]1O	2412.8	Semi standard non polar	33892256
Glucose 6-phosphate,1TBDMS,isomer #4	CC(C)(C)[Si](C)(C)O[C@H]1C(O)O[C@H](COP(=O)(O)O)[C@@H](O)[C@@H]1O	2432.0	Semi standard non polar	33892256
Glucose 6-phosphate,1TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OP(=O)(O)OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O	2523.1	Semi standard non polar	33892256
Glucose 6-phosphate,2TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC1O[C@H](COP(=O)(O)O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1O	2530.7	Semi standard non polar	33892256
Glucose 6-phosphate,2TBDMS,isomer #10	CC(C)(C)[Si](C)(C)O[C@H]1C(O)O[C@H](COP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O	2703.8	Semi standard non polar	33892256
Glucose 6-phosphate,2TBDMS,isomer #11	CC(C)(C)[Si](C)(C)OP(=O)(OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O)O[Si](C)(C)C(C)(C)C	2740.9	Semi standard non polar	33892256
Glucose 6-phosphate,2TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O	2533.8	Semi standard non polar	33892256
Glucose 6-phosphate,2TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C	2535.5	Semi standard non polar	33892256
Glucose 6-phosphate,2TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC1O[C@H](COP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H](O)[C@H]1O	2662.5	Semi standard non polar	33892256
Glucose 6-phosphate,2TBDMS,isomer #5	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)C(O)O[C@@H]1COP(=O)(O)O	2570.9	Semi standard non polar	33892256
Glucose 6-phosphate,2TBDMS,isomer #6	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)O)OC(O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C	2536.1	Semi standard non polar	33892256
Glucose 6-phosphate,2TBDMS,isomer #7	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)O[Si](C)(C)C(C)(C)C)OC(O)[C@H](O)[C@H]1O	2662.0	Semi standard non polar	33892256
Glucose 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(O)O[C@H](COP(=O)(O)O)[C@H]1O	2569.3	Semi standard non polar	33892256
Glucose 6-phosphate,2TBDMS,isomer #9	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](O)C(O)O[C@H](COP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@H]1O	2673.0	Semi standard non polar	33892256
Glucose 6-phosphate,3TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC1O[C@H](COP(=O)(O)O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O	2742.9	Semi standard non polar	33892256
Glucose 6-phosphate,3TBDMS,isomer #10	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)O[Si](C)(C)C(C)(C)C)OC(O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C	2817.6	Semi standard non polar	33892256
Glucose 6-phosphate,3TBDMS,isomer #11	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)OC(O)[C@H](O)[C@H]1O	2845.7	Semi standard non polar	33892256
Glucose 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(O)O[C@H](COP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@H]1O	2848.6	Semi standard non polar	33892256
Glucose 6-phosphate,3TBDMS,isomer #13	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](O)C(O)O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@H]1O	2848.2	Semi standard non polar	33892256
Glucose 6-phosphate,3TBDMS,isomer #14	CC(C)(C)[Si](C)(C)O[C@H]1C(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	2883.1	Semi standard non polar	33892256
Glucose 6-phosphate,3TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC1O[C@H](COP(=O)(O)O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C	2733.6	Semi standard non polar	33892256
Glucose 6-phosphate,3TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC1O[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](O)[C@H]1O	2795.2	Semi standard non polar	33892256
Glucose 6-phosphate,3TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O[Si](C)(C)C(C)(C)C	2753.6	Semi standard non polar	33892256
Glucose 6-phosphate,3TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC1O[C@H](COP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O	2799.9	Semi standard non polar	33892256
Glucose 6-phosphate,3TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC1O[C@H](COP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C	2798.7	Semi standard non polar	33892256
Glucose 6-phosphate,3TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC1O[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](O)[C@H]1O	2831.0	Semi standard non polar	33892256
Glucose 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(O)O[C@H](COP(=O)(O)O)[C@H]1O[Si](C)(C)C(C)(C)C	2790.2	Semi standard non polar	33892256
Glucose 6-phosphate,3TBDMS,isomer #9	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)C(O)O[C@@H]1COP(=O)(O)O[Si](C)(C)C(C)(C)C	2844.5	Semi standard non polar	33892256
Glucose 6-phosphate,4TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC1O[C@H](COP(=O)(O)O)[C@@H](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	2982.3	Semi standard non polar	33892256
Glucose 6-phosphate,4TBDMS,isomer #10	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)OC(O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C	3023.1	Semi standard non polar	33892256
Glucose 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(O)O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@H]1O	3066.5	Semi standard non polar	33892256
Glucose 6-phosphate,4TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC1O[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](O[Si](C)(C)C(C)(C)C)[C@H]1O	2989.1	Semi standard non polar	33892256
Glucose 6-phosphate,4TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC1O[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](O)[C@H]1O[Si](C)(C)C(C)(C)C	3000.9	Semi standard non polar	33892256
Glucose 6-phosphate,4TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC1O[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](O)[C@H]1O	2999.6	Semi standard non polar	33892256
Glucose 6-phosphate,4TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC1O[C@H](COP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O[Si](C)(C)C(C)(C)C	3013.8	Semi standard non polar	33892256
Glucose 6-phosphate,4TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC1O[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](O[Si](C)(C)C(C)(C)C)[C@H]1O	3011.1	Semi standard non polar	33892256
Glucose 6-phosphate,4TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC1O[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](O)[C@H]1O[Si](C)(C)C(C)(C)C	3017.7	Semi standard non polar	33892256
Glucose 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(O)O[C@H](COP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@H]1O[Si](C)(C)C(C)(C)C	3054.8	Semi standard non polar	33892256
Glucose 6-phosphate,4TBDMS,isomer #9	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)C(O)O[C@@H]1COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	3070.2	Semi standard non polar	33892256
Glucose 6-phosphate,5TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC1O[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](O[Si](C)(C)C(C)(C)C)[C@H]1O[Si](C)(C)C(C)(C)C	3237.9	Semi standard non polar	33892256
Glucose 6-phosphate,5TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC1O[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](O[Si](C)(C)C(C)(C)C)[C@H]1O[Si](C)(C)C(C)(C)C	3137.6	Standard non polar	33892256
Glucose 6-phosphate,5TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC1O[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](O[Si](C)(C)C(C)(C)C)[C@H]1O[Si](C)(C)C(C)(C)C	3009.2	Standard polar	33892256
Glucose 6-phosphate,5TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC1O[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](O[Si](C)(C)C(C)(C)C)[C@H]1O	3214.7	Semi standard non polar	33892256
Glucose 6-phosphate,5TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC1O[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](O[Si](C)(C)C(C)(C)C)[C@H]1O	3130.3	Standard non polar	33892256
Glucose 6-phosphate,5TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC1O[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](O[Si](C)(C)C(C)(C)C)[C@H]1O	2948.7	Standard polar	33892256
Glucose 6-phosphate,5TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC1O[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](O)[C@H]1O[Si](C)(C)C(C)(C)C	3228.7	Semi standard non polar	33892256
Glucose 6-phosphate,5TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC1O[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](O)[C@H]1O[Si](C)(C)C(C)(C)C	3159.5	Standard non polar	33892256
Glucose 6-phosphate,5TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC1O[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](O)[C@H]1O[Si](C)(C)C(C)(C)C	2972.5	Standard polar	33892256
Glucose 6-phosphate,5TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC1O[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](O[Si](C)(C)C(C)(C)C)[C@H]1O[Si](C)(C)C(C)(C)C	3232.7	Semi standard non polar	33892256
Glucose 6-phosphate,5TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC1O[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](O[Si](C)(C)C(C)(C)C)[C@H]1O[Si](C)(C)C(C)(C)C	3123.7	Standard non polar	33892256
Glucose 6-phosphate,5TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC1O[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](O[Si](C)(C)C(C)(C)C)[C@H]1O[Si](C)(C)C(C)(C)C	2957.1	Standard polar	33892256
Glucose 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(O)O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@H]1O[Si](C)(C)C(C)(C)C	3275.1	Semi standard non polar	33892256
Glucose 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(O)O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@H]1O[Si](C)(C)C(C)(C)C	3139.9	Standard non polar	33892256
Glucose 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(O)O[C@H](COP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@H]1O[Si](C)(C)C(C)(C)C	2929.4	Standard polar	33892256

Spectra

GC-MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Experimental GC-MS	GC-MS Spectrum - Glucose 6-phosphate GC-EI-TOF (Pegasus III TOF-MS system, Leco; GC 6890, Agilent Technologies) (6 TMS)	splash10-000b-1932000000-59f4881b86595037d013	2014-06-16	HMDB team, MONA, MassBank	View Spectrum
Experimental GC-MS	GC-MS Spectrum - Glucose 6-phosphate GC-EI-TOF (Pegasus III TOF-MS system, Leco; GC 6890, Agilent Technologies) (6 TMS)	splash10-0f7t-1933000000-4894135f21c21c369428	2014-06-16	HMDB team, MONA, MassBank	View Spectrum
Experimental GC-MS	GC-MS Spectrum - Glucose 6-phosphate GC-EI-TOF (Pegasus III TOF-MS system, Leco; GC 6890, Agilent Technologies) (6 TMS; 1 MEOX)	splash10-00di-9522000000-81266970683faa1f2aaf	2014-06-16	HMDB team, MONA, MassBank	View Spectrum
Experimental GC-MS	GC-MS Spectrum - Glucose 6-phosphate GC-EI-TOF (Pegasus III TOF-MS system, Leco; GC 6890, Agilent Technologies) (6 TMS; 1 MEOX)	splash10-00di-9412000000-2f2a0e772025b48bf6f3	2014-06-16	HMDB team, MONA, MassBank	View Spectrum
Experimental GC-MS	GC-MS Spectrum - Glucose 6-phosphate GC-MS (1 MEOX; 6 TMS)	splash10-000j-1956000000-692b4df2b9c16f6a780c	2014-06-16	HMDB team, MONA, MassBank	View Spectrum
Experimental GC-MS	GC-MS Spectrum - Glucose 6-phosphate GC-MS (1 MEOX; 6 TMS)	splash10-000i-1957000000-bd94955ffc1474153a48	2014-06-16	HMDB team, MONA, MassBank	View Spectrum
Experimental GC-MS	GC-MS Spectrum - Glucose 6-phosphate GC-MS (6 TMS)	splash10-0v0a-0596000000-676527ddfc1d596e78f8	2014-06-16	HMDB team, MONA, MassBank	View Spectrum
Experimental GC-MS	GC-MS Spectrum - Glucose 6-phosphate GC-EI-TOF (Non-derivatized)	splash10-000b-1932000000-59f4881b86595037d013	2017-09-12	HMDB team, MONA, MassBank	View Spectrum
Experimental GC-MS	GC-MS Spectrum - Glucose 6-phosphate GC-EI-TOF (Non-derivatized)	splash10-0f7t-1933000000-4894135f21c21c369428	2017-09-12	HMDB team, MONA, MassBank	View Spectrum
Experimental GC-MS	GC-MS Spectrum - Glucose 6-phosphate GC-EI-TOF (Non-derivatized)	splash10-00di-9522000000-81266970683faa1f2aaf	2017-09-12	HMDB team, MONA, MassBank	View Spectrum
Experimental GC-MS	GC-MS Spectrum - Glucose 6-phosphate GC-EI-TOF (Non-derivatized)	splash10-00di-9412000000-2f2a0e772025b48bf6f3	2017-09-12	HMDB team, MONA, MassBank	View Spectrum
Experimental GC-MS	GC-MS Spectrum - Glucose 6-phosphate GC-MS (Non-derivatized)	splash10-000j-1956000000-692b4df2b9c16f6a780c	2017-09-12	HMDB team, MONA, MassBank	View Spectrum
Experimental GC-MS	GC-MS Spectrum - Glucose 6-phosphate GC-MS (Non-derivatized)	splash10-000i-1957000000-bd94955ffc1474153a48	2017-09-12	HMDB team, MONA, MassBank	View Spectrum
Experimental GC-MS	GC-MS Spectrum - Glucose 6-phosphate GC-MS (Non-derivatized)	splash10-0v0a-0596000000-676527ddfc1d596e78f8	2017-09-12	HMDB team, MONA, MassBank	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Glucose 6-phosphate GC-MS (Non-derivatized) - 70eV, Positive	splash10-0005-9740000000-a6e81224fb97751dc2e6	2016-09-22	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Glucose 6-phosphate GC-MS (4 TMS) - 70eV, Positive	splash10-001i-6252790000-ef5662fb1886367e07f2	2017-10-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Glucose 6-phosphate GC-MS (Non-derivatized) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Glucose 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 - Glucose 6-phosphate Quattro_QQQ 10V, N/A-QTOF (Annotated)	splash10-03di-0090000000-5653def80d1b5ff0eebb	2012-07-24	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Glucose 6-phosphate Quattro_QQQ 25V, N/A-QTOF (Annotated)	splash10-000b-9200000000-66741d773ac31b347625	2012-07-24	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Glucose 6-phosphate Quattro_QQQ 40V, N/A-QTOF (Annotated)	splash10-000t-9000000000-068809fcfaff0d387e6b	2012-07-24	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Glucose 6-phosphate LC-ESI-QQ (API3000, Applied Biosystems) 10V, Negative-QTOF	splash10-0a4i-1090000000-d6e539d78b38c01dafea	2012-08-31	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Glucose 6-phosphate LC-ESI-QQ (API3000, Applied Biosystems) 20V, Negative-QTOF	splash10-0002-9210000000-8b9ff1c5095f48a81fef	2012-08-31	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Glucose 6-phosphate LC-ESI-QQ (API3000, Applied Biosystems) 30V, Negative-QTOF	splash10-0002-9000000000-f6e1147852f75db4c0a4	2012-08-31	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Glucose 6-phosphate LC-ESI-QQ (API3000, Applied Biosystems) 40V, Negative-QTOF	splash10-002b-9000000000-1c52fd659f8a2b795e51	2012-08-31	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Glucose 6-phosphate LC-ESI-QQ (API3000, Applied Biosystems) 50V, Negative-QTOF	splash10-004i-9000000000-d3f6a05e18ea6d56c56d	2012-08-31	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Glucose 6-phosphate LC-ESI-QQ (API3000, Applied Biosystems) 10V, Positive-QTOF	splash10-0006-0890000000-5f3047c92c970dfe6927	2012-08-31	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Glucose 6-phosphate LC-ESI-QQ (API3000, Applied Biosystems) 20V, Positive-QTOF	splash10-004i-0900000000-b84eb7685667fa7ee85e	2012-08-31	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Glucose 6-phosphate LC-ESI-QQ (API3000, Applied Biosystems) 30V, Positive-QTOF	splash10-004i-2900000000-d4a0d51bb6e2da28533a	2012-08-31	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Glucose 6-phosphate LC-ESI-QQ (API3000, Applied Biosystems) 40V, Positive-QTOF	splash10-004i-6900000000-dfb5bcbd9a7439c32352	2012-08-31	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Glucose 6-phosphate LC-ESI-QQ (API3000, Applied Biosystems) 50V, Positive-QTOF	splash10-03gi-9600000000-a0922c82e185f6b5aa67	2012-08-31	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Glucose 6-phosphate LC-ESI-IT (LC/MSD Trap XCT, Agilent Technologies) , Positive-QTOF	splash10-0006-0290000000-7ac7b397c52f29cd3822	2012-08-31	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Glucose 6-phosphate LC-ESI-IT (LC/MSD Trap XCT, Agilent Technologies) , Positive-QTOF	splash10-052b-6590000000-5cdbc23378480ac55c4f	2012-08-31	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Glucose 6-phosphate LC-ESI-IT (LC/MSD Trap XCT, Agilent Technologies) , Positive-QTOF	splash10-004i-1900000000-b74270f21c6086362227	2012-08-31	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Glucose 6-phosphate LC-ESI-QTOF (UPLC Q-Tof Premier, Waters) , Negative-QTOF	splash10-002b-9000000000-bc69e8fa215a3b82dcf2	2012-08-31	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Glucose 6-phosphate LC-ESI-QQ , negative-QTOF	splash10-0a4i-0090000000-d6e539d78b38c01dafea	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Glucose 6-phosphate LC-ESI-QQ , negative-QTOF	splash10-0002-9210000000-10019f92fd1eca143bab	2017-09-14	HMDB team, MONA	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Glucose 6-phosphate 10V, Positive-QTOF	splash10-03di-0490000000-94ea79ec673f4688b7a0	2016-09-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Glucose 6-phosphate 20V, Positive-QTOF	splash10-03dm-5940000000-c649262446626dcb8d6e	2016-09-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Glucose 6-phosphate 40V, Positive-QTOF	splash10-0uka-9800000000-aae2cb792906d2dec6cd	2016-09-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Glucose 6-phosphate 10V, Negative-QTOF	splash10-0a6r-8290000000-8e20219f94b3fe964e38	2016-09-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Glucose 6-phosphate 20V, Negative-QTOF	splash10-004i-9000000000-b19b64f5cb4124047baf	2016-09-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Glucose 6-phosphate 40V, Negative-QTOF	splash10-004i-9000000000-ecb75a44e3d25affdf31	2016-09-12	Wishart Lab	View Spectrum

NMR Spectra

Spectrum Type	Description	Deposition Date	Source	View
Experimental 1D NMR	¹H NMR Spectrum (1D, 600 MHz, H₂O, experimental)	2012-12-04	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Experimental 2D NMR	[¹H, ¹³C]-HSQC NMR Spectrum (2D, 600 MHz, H₂O, experimental)	2012-12-05	Wishart Lab	View Spectrum

Biological Properties

Cellular Locations

Endoplasmic reticulum

Biospecimen Locations

Blood
Cellular Cytoplasm
Feces
Saliva
Urine

Tissue Locations

Adipose Tissue
Adrenal Gland
Fibroblasts
Kidney
Liver
Placenta
Skeletal Muscle

Pathways

Name	SMPDB/PathBank	KEGG
Gluconeogenesis
pentose phosphate pathway	Not Available	Not Available
Inositol phosphate metabolism	Not Available
Starch and Sucrose Metabolism
Glycolysis

Normal Concentrations

Biospecimen	Status	Value	Age	Sex	Condition	Reference	Details
Blood	Detected but not Quantified	Not Quantified	Adult (>18 years old)	Both	Normal	32966057	details
Blood	Detected and Quantified	4.52 +/- 8.7 uM	Newborn (0-30 days old)	Both	Normal	Geigy Scientific ...	details
Blood	Detected and Quantified	29.1 +/- 6.8 uM	Adult (>18 years old)	Both	Normal	Geigy Scientific ...	details
Cellular Cytoplasm	Detected and Quantified	38.0 (26.0-50.0) uM	Adult (>18 years old)	Both	Normal	15882454	details
Feces	Detected but not Quantified	Not Quantified	Adult (>18 years old)	Both	Normal	25037050	details
Saliva	Detected and Quantified	6.88 +/- 3.72 uM	Adult (>18 years old)	Female	Normal	23857558	details
Saliva	Detected and Quantified	1.60 +/- 1.19 uM	Adult (>18 years old)	Both	Normal	Sugimoto et al. (...	details
Saliva	Detected and Quantified	1.73 +/- 1.28 uM	Adult (>18 years old)	Not Specified	Normal	Sugimoto et al. (...	details
Saliva	Detected and Quantified	2.23 +/- 5.59 uM	Adult (>18 years old)	Not Specified	Normal	Sugimoto et al. (...	details
Saliva	Detected and Quantified	2.42 +/- 1.55 uM	Adult (>18 years old)	Both	Normal	Sugimoto et al. (...	details
Urine	Detected but not Quantified	Not Quantified	Adult (>18 years old)	Both	Normal	32966057	details

Abnormal Concentrations

Biospecimen	Status	Value	Age	Sex	Condition	Reference	Details
Feces	Detected but not Quantified	Not Quantified	Adult (>18 years old)	Both	Colorectal cancer	25037050	details
Saliva	Detected and Quantified	4.06 +/- 0.96 uM	Adult (>18 years old)	Male	Alzheimer's disease	23857558	details
Saliva	Detected and Quantified	5.51 +/- 3.94 uM	Adult (>18 years old)	Male	Frontotemporal lobe dementia	23857558	details
Saliva	Detected and Quantified	7.79 +/- 8.06 uM	Adult (>18 years old)	Both	Lewy body disease	23857558	details
Urine	Detected and Quantified	44.163 umol/mmol creatinine	Children (1 - 13 years old)	Not Specified	Eosinophilic esophagitis	Analysis of 30 no...	details

Associated Disorders and Diseases

Disease References

Colorectal cancer
Goedert JJ, Sampson JN, Moore SC, Xiao Q, Xiong X, Hayes RB, Ahn J, Shi J, Sinha R: Fecal metabolomics: assay performance and association with colorectal cancer. Carcinogenesis. 2014 Sep;35(9):2089-96. doi: 10.1093/carcin/bgu131. Epub 2014 Jul 18. [PubMed:25037050 ]
Alzheimer's disease
Tsuruoka M, Hara J, Hirayama A, Sugimoto M, Soga T, Shankle WR, Tomita M: Capillary electrophoresis-mass spectrometry-based metabolome analysis of serum and saliva from neurodegenerative dementia patients. Electrophoresis. 2013 Oct;34(19):2865-72. doi: 10.1002/elps.201300019. Epub 2013 Sep 6. [PubMed:23857558 ]
Frontotemporal dementia
Tsuruoka M, Hara J, Hirayama A, Sugimoto M, Soga T, Shankle WR, Tomita M: Capillary electrophoresis-mass spectrometry-based metabolome analysis of serum and saliva from neurodegenerative dementia patients. Electrophoresis. 2013 Oct;34(19):2865-72. doi: 10.1002/elps.201300019. Epub 2013 Sep 6. [PubMed:23857558 ]
Lewy body disease
Tsuruoka M, Hara J, Hirayama A, Sugimoto M, Soga T, Shankle WR, Tomita M: Capillary electrophoresis-mass spectrometry-based metabolome analysis of serum and saliva from neurodegenerative dementia patients. Electrophoresis. 2013 Oct;34(19):2865-72. doi: 10.1002/elps.201300019. Epub 2013 Sep 6. [PubMed:23857558 ]
Eosinophilic esophagitis
Slae, M., Huynh, H., Wishart, D.S. (2014). Analysis of 30 normal pediatric urine samples via NMR spectroscopy (unpublished work). NA.

Associated OMIM IDs

114500 (Colorectal cancer)
104300 (Alzheimer's disease)
600274 (Frontotemporal dementia)
610247 (Eosinophilic esophagitis)

External Links

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FooDB ID

KNApSAcK ID

Chemspider ID

KEGG Compound ID

BioCyc ID

D-glucose-6-phosphate

BiGG ID

Wikipedia Link

METLIN ID

PubChem Compound

PDB ID

Not Available

ChEBI ID

4170

Food Biomarker Ontology

Not Available

VMH ID

G6P

MarkerDB ID

MDB00029998

Good Scents ID

Not Available

References

Synthesis Reference

Not Available

Material Safety Data Sheet (MSDS)

Not Available

General References

Nakayama Y, Kinoshita A, Tomita M: Dynamic simulation of red blood cell metabolism and its application to the analysis of a pathological condition. Theor Biol Med Model. 2005 May 9;2:18. [PubMed:15882454 ]
Price TB, Laurent D, Petersen KF: 13C/31P NMR studies on the role of glucose transport/phosphorylation in human glycogen supercompensation. Int J Sports Med. 2003 May;24(4):238-44. [PubMed:12784164 ]
Boden G, Jadali F, White J, Liang Y, Mozzoli M, Chen X, Coleman E, Smith C: Effects of fat on insulin-stimulated carbohydrate metabolism in normal men. J Clin Invest. 1991 Sep;88(3):960-6. [PubMed:1885781 ]
Lehto M, Xiang K, Stoffel M, Espinosa R 3rd, Groop LC, Le Beau MM, Bell GI: Human hexokinase II: localization of the polymorphic gene to chromosome 2. Diabetologia. 1993 Dec;36(12):1299-302. [PubMed:8307259 ]
Brehm A, Krssak M, Schmid AI, Nowotny P, Waldhausl W, Roden M: Increased lipid availability impairs insulin-stimulated ATP synthesis in human skeletal muscle. Diabetes. 2006 Jan;55(1):136-40. [PubMed:16380486 ]
Roden M: How free fatty acids inhibit glucose utilization in human skeletal muscle. News Physiol Sci. 2004 Jun;19:92-6. [PubMed:15143200 ]
Chang PY, Jensen J, Printz RL, Granner DK, Ivy JL, Moller DE: Overexpression of hexokinase II in transgenic mice. Evidence that increased phosphorylation augments muscle glucose uptake. J Biol Chem. 1996 Jun 21;271(25):14834-9. [PubMed:8662926 ]
Schalin-Jantti C, Harkonen M, Groop LC: Impaired activation of glycogen synthase in people at increased risk for developing NIDDM. Diabetes. 1992 May;41(5):598-604. [PubMed:1568529 ]
Vaag A, Damsbo P, Hother-Nielsen O, Beck-Nielsen H: Hyperglycaemia compensates for the defects in insulin-mediated glucose metabolism and in the activation of glycogen synthase in the skeletal muscle of patients with type 2 (non-insulin-dependent) diabetes mellitus. Diabetologia. 1992 Jan;35(1):80-8. [PubMed:1541385 ]
Fortpied J, Maliekal P, Vertommen D, Van Schaftingen E: Magnesium-dependent phosphatase-1 is a protein-fructosamine-6-phosphatase potentially involved in glycation repair. J Biol Chem. 2006 Jul 7;281(27):18378-85. Epub 2006 May 1. [PubMed:16670083 ]
Cline GW, Petersen KF, Krssak M, Shen J, Hundal RS, Trajanoski Z, Inzucchi S, Dresner A, Rothman DL, Shulman GI: Impaired glucose transport as a cause of decreased insulin-stimulated muscle glycogen synthesis in type 2 diabetes. N Engl J Med. 1999 Jul 22;341(4):240-6. [PubMed:10413736 ]
Foster JD, Pederson BA, Nordlie RC: Glucose-6-phosphatase structure, regulation, and function: an update. Proc Soc Exp Biol Med. 1997 Sep;215(4):314-32. [PubMed:9270716 ]
Turvey EA, Heigenhauser GJ, Parolin M, Peters SJ: Elevated n-3 fatty acids in a high-fat diet attenuate the increase in PDH kinase activity but not PDH activity in human skeletal muscle. J Appl Physiol (1985). 2005 Jan;98(1):350-5. [PubMed:15591305 ]
Benkoel L, Chamlian A, Barrat E, Laffargue P: The use of ferricyanide for the electron microscopic demonstration of dehydrogenases in human steroidogenic cells. J Histochem Cytochem. 1976 Nov;24(11):1194-203. [PubMed:1002973 ]
Villar-Palasi C, Guinovart JJ: The role of glucose 6-phosphate in the control of glycogen synthase. FASEB J. 1997 Jun;11(7):544-58. [PubMed:9212078 ]
Vestergaard H, Bjorbaek C, Hansen T, Larsen FS, Granner DK, Pedersen O: Impaired activity and gene expression of hexokinase II in muscle from non-insulin-dependent diabetes mellitus patients. J Clin Invest. 1995 Dec;96(6):2639-45. [PubMed:8675629 ]
Roussel R, Carlier PG, Wary C, Velho G, Bloch G: Evidence for 100% 13C NMR visibility of glucose in human skeletal muscle. Magn Reson Med. 1997 Jun;37(6):821-4. [PubMed:9178231 ]
Cigolini M, Bonora E, Querena M, Moghetti P, Cacciatori V, Zancanaro C, Benati D, Muggeo M: Differences in glucose metabolic enzyme activities in human adipose tissue from abdominal and gluteal regions. Metabolism. 1988 Sep;37(9):820-3. [PubMed:3419322 ]
Petersen KF, Hendler R, Price T, Perseghin G, Rothman DL, Held N, Amatruda JM, Shulman GI: 13C/31P NMR studies on the mechanism of insulin resistance in obesity. Diabetes. 1998 Mar;47(3):381-6. [PubMed:9519743 ]
Boden G, Chen X, Ruiz J, White JV, Rossetti L: Mechanisms of fatty acid-induced inhibition of glucose uptake. J Clin Invest. 1994 Jun;93(6):2438-46. [PubMed:8200979 ]
Elshenawy S, Pinney SE, Stuart T, Doulias PT, Zura G, Parry S, Elovitz MA, Bennett MJ, Bansal A, Strauss JF 3rd, Ischiropoulos H, Simmons RA: The Metabolomic Signature of the Placenta in Spontaneous Preterm Birth. Int J Mol Sci. 2020 Feb 4;21(3). pii: ijms21031043. doi: 10.3390/ijms21031043. [PubMed:32033212 ]

Only showing the first 10 proteins. There are 20 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

Reactions

Adenosine triphosphate + D-Glucose → ADP + Glucose 6-phosphate	details
Adenosine triphosphate + alpha-D-Glucose → ADP + Glucose 6-phosphate	details

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-Galactose → ADP + Glucose 6-phosphate	details
Adenosine triphosphate + D-Glucose → ADP + Glucose 6-phosphate	details
Adenosine triphosphate + alpha-D-Glucose → ADP + Glucose 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-Galactose → ADP + Glucose 6-phosphate	details
Adenosine triphosphate + D-Glucose → ADP + Glucose 6-phosphate	details
Adenosine triphosphate + alpha-D-Glucose → ADP + Glucose 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-Galactose → ADP + Glucose 6-phosphate	details
Adenosine triphosphate + D-Glucose → ADP + Glucose 6-phosphate	details
Adenosine triphosphate + alpha-D-Glucose → ADP + Glucose 6-phosphate	details

Enzyme Details

5. Glucose-6-phosphate 1-dehydrogenase

General function:: Involved in glucose-6-phosphate dehydrogenase activity
Specific function:: Produces pentose sugars for nucleic acid synthesis and main producer of NADPH reducing power.
Gene Name:: G6PD
Uniprot ID:: P11413
Molecular weight:: 62467.88

Reactions

Glucose 6-phosphate + NADP → 6-phospho-D-glucono-1,5-lactone + NADPH	details

Enzyme Details

6. GDH/6PGL endoplasmic bifunctional protein

General function:: Involved in 6-phosphogluconolactonase activity
Specific function:: Oxidizes glucose-6-phosphate and glucose, as well as other hexose-6-phosphates.
Gene Name:: H6PD
Uniprot ID:: O95479
Molecular weight:: 88891.99

Reactions

Glucose 6-phosphate + NAD(P)(+) → 6-Phosphonoglucono-D-lactone + NAD(P)H	details

Enzyme Details

7. ADP-dependent glucokinase

General function:: Involved in phosphotransferase activity, alcohol group as acceptor
Specific function:: Catalyzes the phosphorylation of D-glucose to D-glucose 6-phosphate using ADP as the phosphate donor. GDP and CDP can replace ADP, but with reduced efficiency (By similarity).
Gene Name:: ADPGK
Uniprot ID:: Q9BRR6
Molecular weight:: 53960.185

Reactions

ADP + D-Glucose → Adenosine monophosphate + Glucose 6-phosphate	details
alpha-D-Glucose + ADP → Glucose 6-phosphate + Adenosine monophosphate	details

Enzyme Details

8. Glycogen phosphorylase, liver form

General function:: Involved in phosphorylase activity
Specific function:: Phosphorylase is an important allosteric enzyme in carbohydrate metabolism. Enzymes from different sources differ in their regulatory mechanisms and in their natural substrates. However, all known phosphorylases share catalytic and structural properties.
Gene Name:: PYGL
Uniprot ID:: P06737
Molecular weight:: 93133.25

Enzyme Details

9. Glycogen phosphorylase, muscle form

General function:: Involved in phosphorylase activity
Specific function:: Phosphorylase is an important allosteric enzyme in carbohydrate metabolism. Enzymes from different sources differ in their regulatory mechanisms and in their natural substrates. However, all known phosphorylases share catalytic and structural properties.
Gene Name:: PYGM
Uniprot ID:: P11217
Molecular weight:: 87316.355

Enzyme Details

10. Glycogen phosphorylase, brain form

General function:: Involved in phosphorylase activity
Specific function:: Phosphorylase is an important allosteric enzyme in carbohydrate metabolism. Enzymes from different sources differ in their regulatory mechanisms and in their natural substrates. However, all known phosphorylases share catalytic and structural properties.
Gene Name:: PYGB
Uniprot ID:: P11216
Molecular weight:: 96695.18

Only showing the first 10 proteins. There are 20 proteins in total.

Show all enzymes and transporters

Showing metabocard for Glucose 6-phosphate (HMDB0001401)

MOL for HMDB0001401 (Glucose 6-phosphate)

3D MOL for HMDB0001401 (Glucose 6-phosphate)

3D SDF for HMDB0001401 (Glucose 6-phosphate)

3D-SDF for HMDB0001401 (Glucose 6-phosphate)

PDB for HMDB0001401 (Glucose 6-phosphate)

3D PDB for HMDB0001401 (Glucose 6-phosphate)

SMILES for HMDB0001401 (Glucose 6-phosphate)

INCHI for HMDB0001401 (Glucose 6-phosphate)

Structure for HMDB0001401 (Glucose 6-phosphate)

3D Structure for HMDB0001401 (Glucose 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

Reactions

Reactions

Reactions

Reactions

Reactions

Reactions

Reactions