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Record Information

Version

5.0

Status

Detected and Quantified

Creation Date

2005-11-16 15:48:42 UTC

Update Date

2021-09-14 15:44:38 UTC

HMDB ID

HMDB0000645

Secondary Accession Numbers

HMDB0003359
HMDB0062705
HMDB00645
HMDB03359
HMDB62705

Metabolite Identification

Common Name

Galactose 1-phosphate

Description

Galactose 1-phosphate, also known as D-Galactose-1-phosphate or alpha-D-gal-1-P, belongs to the class of organic compounds known as monosaccharide phosphates. These are monosaccharides comprising a phosphate group linked to the carbohydrate unit. Galactose-1-phosphate is an intermediate in the interconversion of glucose and uridine diphosphate galactose. Galactose 1-phosphate exists in all living species, ranging from bacteria to plants to humans. Within humans, galactose 1-phosphate participates in a number of enzymatic reactions. In particular, uridine diphosphate glucose and galactose 1-phosphate can be biosynthesized from uridine diphosphategalactose and glucose 1-phosphate; which is mediated by the enzyme galactose-1-phosphate uridylyltransferase (GALT). In addition, galactose 1-phosphate can be biosynthesized from D-galactose through the action of the enzyme galactokinase. The improper metabolism of galactose-1-phosphate is a characteristic of a condition known as galactosemia (PMID: 7671964 ). Type I galactosemia is a genetic disorder that is caused by the impairment of galactose-1-phosphate uridylyltransferase (EC 2.7.7.12). Evidence suggests that misfolding of the galactose 1-phosphate uridylyltransferase enzyme is the underlying cause of type I galactosemia (PMID: 23583749 ). Outside of the human body, galactose 1-phosphate has been detected, but not quantified in, several different foods, such as gooseberries, anises, turmerics, caraway, and cumins.

Structure

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

HMDB0000645
     RDKit          3D
Galactose 1-phosphate
 29 29  0  0  0  0  0  0  0  0999 V2000
    4.1206   -0.3372    1.5655 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2364   -0.5817    0.3503 P   0  0  0  0  0  5  0  0  0  0  0  0
    3.8534    0.3445   -0.9212 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2107   -2.1999   -0.0936 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6792   -0.0193    0.6869 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9211   -0.1020   -0.4772 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.1325   -0.9644   -0.2884 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8921   -0.5486    0.7910 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.9440   -1.6286    1.0310 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6903   -1.7035   -0.1515 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5628    0.7765    0.5028 C   0  0  2  0  0  0  0  0  0  0  0  0
   -2.9655    0.6328    0.4377 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0598    1.2803   -0.8254 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.4253    0.3700   -1.8306 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4541    1.3085   -0.7942 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.9512    2.2398    0.1014 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7489    1.3118   -0.7579 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9126   -2.6959    0.4197 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5305   -0.5145   -1.3251 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2902   -0.4724    1.7119 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5599   -1.4274    1.9113 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4092   -2.5897    1.1465 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1558   -2.5468   -0.2697 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3318    1.5037    1.2902 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2950    1.5671    0.2501 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4637    2.3002   -1.0394 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3878    0.3765   -2.0166 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7795    1.5623   -1.8398 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1673    2.7581    0.4343 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
  8 11  1  0
 11 12  1  0
 11 13  1  0
 13 14  1  0
 13 15  1  0
 15 16  1  0
 15  6  1  0
  3 17  1  0
  4 18  1  0
  6 19  1  6
  8 20  1  1
  9 21  1  0
  9 22  1  0
 10 23  1  0
 11 24  1  1
 12 25  1  0
 13 26  1  6
 14 27  1  0
 15 28  1  6
 16 29  1  0
M  END

ChEBI
  Mrv1652309042000052D          

 16 16  0  0  1  0            999 V2000
   13.1039   -7.9403    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   12.3854   -7.5259    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.1039   -8.7653    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   13.8224   -7.5259    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.6668   -7.9403    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   12.3854   -9.1835    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   13.8224   -9.1835    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.6474   -7.5259    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   11.6668   -8.7653    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   10.9597   -7.5259    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3854  -10.0084    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.4761   -7.5259    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.6474   -6.7009    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.6474   -8.3546    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9597   -9.1835    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.3363   -7.9555    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  6  0  0  0
  2  5  1  0  0  0  0
  3  6  1  0  0  0  0
  3  7  1  6  0  0  0
  4  8  1  0  0  0  0
  5  9  1  0  0  0  0
  5 10  1  1  0  0  0
  6 11  1  1  0  0  0
  8 12  1  0  0  0  0
  8 13  1  0  0  0  0
  8 14  2  0  0  0  0
  9 15  1  1  0  0  0
 10 16  1  0  0  0  0
  6  9  1  0  0  0  0
M  END
> <DATABASE_ID>
HMDB0000645

> <DATABASE_NAME>
hmdb

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

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

> <INCHI_KEY>
HXXFSFRBOHSIMQ-FPRJBGLDSA-N

> <FORMULA>
C6H13O9P

> <MOLECULAR_WEIGHT>
260.1358

> <EXACT_MASS>
260.029718526

> <JCHEM_ACCEPTOR_COUNT>
8

> <JCHEM_ATOM_COUNT>
29

> <JCHEM_AVERAGE_POLARIZABILITY>
20.62028301430712

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
6

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
{[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phosphonic acid

> <ALOGPS_LOGP>
-2.00

> <JCHEM_LOGP>
-3.056105249333333

> <ALOGPS_LOGS>
-0.91

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
1

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-2

> <JCHEM_PKA>
6.218893458242332

> <JCHEM_PKA_STRONGEST_ACIDIC>
1.1553718480897146

> <JCHEM_PKA_STRONGEST_BASIC>
-2.9810995814615806

> <JCHEM_POLAR_SURFACE_AREA>
156.91

> <JCHEM_REFRACTIVITY>
46.796299999999995

> <JCHEM_ROTATABLE_BOND_COUNT>
3

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
3.23e+01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
galactose 1 phosphate

> <JCHEM_VEBER_RULE>
0

$$$$

HMDB0000645
     RDKit          3D
Galactose 1-phosphate
 29 29  0  0  0  0  0  0  0  0999 V2000
    4.1206   -0.3372    1.5655 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2364   -0.5817    0.3503 P   0  0  0  0  0  5  0  0  0  0  0  0
    3.8534    0.3445   -0.9212 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2107   -2.1999   -0.0936 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6792   -0.0193    0.6869 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9211   -0.1020   -0.4772 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.1325   -0.9644   -0.2884 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8921   -0.5486    0.7910 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.9440   -1.6286    1.0310 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6903   -1.7035   -0.1515 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5628    0.7765    0.5028 C   0  0  2  0  0  0  0  0  0  0  0  0
   -2.9655    0.6328    0.4377 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0598    1.2803   -0.8254 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.4253    0.3700   -1.8306 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4541    1.3085   -0.7942 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.9512    2.2398    0.1014 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7489    1.3118   -0.7579 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9126   -2.6959    0.4197 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5305   -0.5145   -1.3251 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2902   -0.4724    1.7119 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5599   -1.4274    1.9113 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4092   -2.5897    1.1465 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1558   -2.5468   -0.2697 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3318    1.5037    1.2902 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2950    1.5671    0.2501 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4637    2.3002   -1.0394 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3878    0.3765   -2.0166 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7795    1.5623   -1.8398 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1673    2.7581    0.4343 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
  8 11  1  0
 11 12  1  0
 11 13  1  0
 13 14  1  0
 13 15  1  0
 15 16  1  0
 15  6  1  0
  3 17  1  0
  4 18  1  0
  6 19  1  6
  8 20  1  1
  9 21  1  0
  9 22  1  0
 10 23  1  0
 11 24  1  1
 12 25  1  0
 13 26  1  6
 14 27  1  0
 15 28  1  6
 16 29  1  0
M  END

HEADER    PROTEIN                                 04-SEP-20   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: ChEBI                                             
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   04-SEP-20         0                                  
HETATM    1  C   UNK     0      24.461 -14.822   0.000  0.00  0.00           C+0
HETATM    2  O   UNK     0      23.119 -14.048   0.000  0.00  0.00           O+0
HETATM    3  C   UNK     0      24.461 -16.362   0.000  0.00  0.00           C+0
HETATM    4  O   UNK     0      25.802 -14.048   0.000  0.00  0.00           O+0
HETATM    5  C   UNK     0      21.778 -14.822   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0      23.119 -17.143   0.000  0.00  0.00           C+0
HETATM    7  O   UNK     0      25.802 -17.143   0.000  0.00  0.00           O+0
HETATM    8  P   UNK     0      27.342 -14.048   0.000  0.00  0.00           P+0
HETATM    9  C   UNK     0      21.778 -16.362   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      20.458 -14.048   0.000  0.00  0.00           C+0
HETATM   11  O   UNK     0      23.119 -18.682   0.000  0.00  0.00           O+0
HETATM   12  O   UNK     0      28.889 -14.048   0.000  0.00  0.00           O+0
HETATM   13  O   UNK     0      27.342 -12.508   0.000  0.00  0.00           O+0
HETATM   14  O   UNK     0      27.342 -15.595   0.000  0.00  0.00           O+0
HETATM   15  O   UNK     0      20.458 -17.143   0.000  0.00  0.00           O+0
HETATM   16  O   UNK     0      19.294 -14.850   0.000  0.00  0.00           O+0
CONECT    1    2    3    4                                                  
CONECT    2    1    5                                                       
CONECT    3    1    6    7                                                  
CONECT    4    1    8                                                       
CONECT    5    2    9   10                                                  
CONECT    6    3   11    9                                                  
CONECT    7    3                                                            
CONECT    8    4   12   13   14                                             
CONECT    9    5   15    6                                                  
CONECT   10    5   16                                                       
CONECT   11    6                                                            
CONECT   12    8                                                            
CONECT   13    8                                                            
CONECT   14    8                                                            
CONECT   15    9                                                            
CONECT   16   10                                                            
MASTER        0    0    0    0    0    0    0    0   16    0   32    0
END

COMPND    HMDB0000645
HETATM    1  O1  UNL     1       4.121  -0.337   1.566  1.00  0.00           O  
HETATM    2  P1  UNL     1       3.236  -0.582   0.350  1.00  0.00           P  
HETATM    3  O2  UNL     1       3.853   0.344  -0.921  1.00  0.00           O  
HETATM    4  O3  UNL     1       3.211  -2.200  -0.094  1.00  0.00           O  
HETATM    5  O4  UNL     1       1.679  -0.019   0.687  1.00  0.00           O  
HETATM    6  C1  UNL     1       0.921  -0.102  -0.477  1.00  0.00           C  
HETATM    7  O5  UNL     1      -0.133  -0.964  -0.288  1.00  0.00           O  
HETATM    8  C2  UNL     1      -0.892  -0.549   0.791  1.00  0.00           C  
HETATM    9  C3  UNL     1      -1.944  -1.629   1.031  1.00  0.00           C  
HETATM   10  O6  UNL     1      -2.690  -1.703  -0.152  1.00  0.00           O  
HETATM   11  C4  UNL     1      -1.563   0.776   0.503  1.00  0.00           C  
HETATM   12  O7  UNL     1      -2.966   0.633   0.438  1.00  0.00           O  
HETATM   13  C5  UNL     1      -1.060   1.280  -0.825  1.00  0.00           C  
HETATM   14  O8  UNL     1      -1.425   0.370  -1.831  1.00  0.00           O  
HETATM   15  C6  UNL     1       0.454   1.309  -0.794  1.00  0.00           C  
HETATM   16  O9  UNL     1       0.951   2.240   0.101  1.00  0.00           O  
HETATM   17  H1  UNL     1       3.749   1.312  -0.758  1.00  0.00           H  
HETATM   18  H2  UNL     1       3.913  -2.696   0.420  1.00  0.00           H  
HETATM   19  H3  UNL     1       1.531  -0.515  -1.325  1.00  0.00           H  
HETATM   20  H4  UNL     1      -0.290  -0.472   1.712  1.00  0.00           H  
HETATM   21  H5  UNL     1      -2.560  -1.427   1.911  1.00  0.00           H  
HETATM   22  H6  UNL     1      -1.409  -2.590   1.147  1.00  0.00           H  
HETATM   23  H7  UNL     1      -3.156  -2.547  -0.270  1.00  0.00           H  
HETATM   24  H8  UNL     1      -1.332   1.504   1.290  1.00  0.00           H  
HETATM   25  H9  UNL     1      -3.295   1.567   0.250  1.00  0.00           H  
HETATM   26  H10 UNL     1      -1.464   2.300  -1.039  1.00  0.00           H  
HETATM   27  H11 UNL     1      -2.388   0.377  -2.017  1.00  0.00           H  
HETATM   28  H12 UNL     1       0.779   1.562  -1.840  1.00  0.00           H  
HETATM   29  H13 UNL     1       0.167   2.758   0.434  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   15   19
CONECT    7    8
CONECT    8    9   11   20
CONECT    9   10   21   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

HMDB0000645
     RDKit          3D
Galactose 1-phosphate
 29 29  0  0  0  0  0  0  0  0999 V2000
    4.1206   -0.3372    1.5655 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2364   -0.5817    0.3503 P   0  0  0  0  0  5  0  0  0  0  0  0
    3.8534    0.3445   -0.9212 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2107   -2.1999   -0.0936 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6792   -0.0193    0.6869 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9211   -0.1020   -0.4772 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.1325   -0.9644   -0.2884 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8921   -0.5486    0.7910 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.9440   -1.6286    1.0310 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6903   -1.7035   -0.1515 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5628    0.7765    0.5028 C   0  0  2  0  0  0  0  0  0  0  0  0
   -2.9655    0.6328    0.4377 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0598    1.2803   -0.8254 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.4253    0.3700   -1.8306 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4541    1.3085   -0.7942 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.9512    2.2398    0.1014 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7489    1.3118   -0.7579 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9126   -2.6959    0.4197 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5305   -0.5145   -1.3251 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2902   -0.4724    1.7119 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5599   -1.4274    1.9113 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4092   -2.5897    1.1465 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1558   -2.5468   -0.2697 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3318    1.5037    1.2902 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2950    1.5671    0.2501 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4637    2.3002   -1.0394 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3878    0.3765   -2.0166 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7795    1.5623   -1.8398 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1673    2.7581    0.4343 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
  8 11  1  0
 11 12  1  0
 11 13  1  0
 13 14  1  0
 13 15  1  0
 15 16  1  0
 15  6  1  0
  3 17  1  0
  4 18  1  0
  6 19  1  6
  8 20  1  1
  9 21  1  0
  9 22  1  0
 10 23  1  0
 11 24  1  1
 12 25  1  0
 13 26  1  6
 14 27  1  0
 15 28  1  6
 16 29  1  0
M  END

View in JSmol View NMR Assignments View Stereo Labels

Synonyms

Value	Source
1-O-Phosphono-alpha-D-galactopyranose	ChEBI
alpha-D-Gal-1-p	ChEBI
alpha-D-Galactopyranose 1-phosphate	ChEBI
alpha-D-Galactopyranose, 1-(dihydrogen phosphate)	ChEBI
alpha-D-Galactopyranosyl phosphate	ChEBI
alpha-D-Galactosyl phosphate	ChEBI
Galactose-1-phosphate	ChEBI
1-O-Phosphono-a-D-galactopyranose	Generator
1-O-Phosphono-α-D-galactopyranose	Generator
a-D-Gal-1-p	Generator
Α-D-gal-1-p	Generator
a-D-Galactopyranose 1-phosphate	Generator
a-D-Galactopyranose 1-phosphoric acid	Generator
alpha-D-Galactopyranose 1-phosphoric acid	Generator
Α-D-galactopyranose 1-phosphate	Generator
Α-D-galactopyranose 1-phosphoric acid	Generator
a-D-Galactopyranose, 1-(dihydrogen phosphate)	Generator
a-D-Galactopyranose, 1-(dihydrogen phosphoric acid)	Generator
alpha-D-Galactopyranose, 1-(dihydrogen phosphoric acid)	Generator
Α-D-galactopyranose, 1-(dihydrogen phosphate)	Generator
Α-D-galactopyranose, 1-(dihydrogen phosphoric acid)	Generator
a-D-Galactopyranosyl phosphate	Generator
a-D-Galactopyranosyl phosphoric acid	Generator
alpha-D-Galactopyranosyl phosphoric acid	Generator
Α-D-galactopyranosyl phosphate	Generator
Α-D-galactopyranosyl phosphoric acid	Generator
a-D-Galactosyl phosphate	Generator
a-D-Galactosyl phosphoric acid	Generator
alpha-D-Galactosyl phosphoric acid	Generator
Α-D-galactosyl phosphate	Generator
Α-D-galactosyl phosphoric acid	Generator
Galactose-1-phosphoric acid	Generator
Galactose 1-phosphoric acid	Generator
a-D-Galactose-1-phosphate	HMDB
a-D-Galactose-1-phosphoric acid	HMDB
alpha-D-Galactose-1-phosphoric acid	HMDB
Α-D-galactose-1-phosphate	HMDB
Α-D-galactose-1-phosphoric acid	HMDB
Galactose-1-phosphate, (beta-L-gal)-isomer	HMDB
Galactose-1-phosphate, 14C-labeled	HMDB
Galactose-1-phosphate, disilver (+1) salt, (D-gal)-isomer	HMDB
Galactose-1-phosphate, sodium salt	HMDB
Galactose-1-phosphate, (beta-D-gal)-isomer	HMDB
1-(Dihydrogen phosphate) galactitol	HMDB
1-Phosphate a-D-galactopyranose	HMDB
a-D-1-(Dihydrogen phosphate) galactopyranose	HMDB
a-D-Galactose 1-phosphate	HMDB
alpha-D-1-(Dihydrogen phosphate) galactopyranose	HMDB
alpha-D-Galactose 1-phosphate	HMDB
D-Galactose 1-phosphate	HMDB
Galactopyranose 1-phosphate	HMDB
D-Galactopyranose 1-phosphate	HMDB
D-Galactopyranose 1-phosphoric acid	HMDB
D-Galactose 1-phosphoric acid	HMDB

Chemical Formula

C₆H₁₃O₉P

Average Molecular Weight

260.1358

Monoisotopic Molecular Weight

260.029718526

IUPAC Name

{[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phosphonic acid

Traditional Name

galactose 1 phosphate

CAS Registry Number

2255-14-3

SMILES

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

InChI Identifier

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

InChI Key

HXXFSFRBOHSIMQ-FPRJBGLDSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as monosaccharide phosphates. These are monosaccharides comprising a phosphated group linked to the carbohydrate unit.

Kingdom

Organic compounds

Super Class

Organic oxygen compounds

Class

Organooxygen compounds

Sub Class

Carbohydrates and carbohydrate conjugates

Direct Parent

Monosaccharide phosphates

Alternative Parents

Substituents

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

Molecular Framework

Aliphatic heteromonocyclic compounds

External Descriptors

D-galactopyranose 1-phosphate (CHEBI:17973 )
alpha-D-hexose 1-phosphate (CHEBI:17973 )

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

Experimental Collision Cross Sections

Adduct Type	Data Source	CCS Value (Å²)	Reference
[M-H]-	Not Available	147.3	http://allccs.zhulab.cn/database/detail?ID=AllCCS00000378

Predicted Molecular Properties

Property	Value	Source
Water Solubility	32.3 g/L	ALOGPS
logP	-2	ALOGPS
logP	-3.1	ChemAxon
logS	-0.91	ALOGPS
pKa (Strongest Acidic)	1.16	ChemAxon
pKa (Strongest Basic)	-3	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	20.62 Å³	ChemAxon
Number of Rings	1	ChemAxon
Bioavailability	Yes	ChemAxon
Rule of Five	No	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	No	ChemAxon

Predicted Chromatographic Properties

Predicted Collision Cross Sections

Predictor	Adduct Type	CCS Value (Å²)	Reference
DarkChem	[M+H]+	157.938	31661259
DarkChem	[M-H]-	151.113	31661259
AllCCS	[M+H]+	156.388	32859911
AllCCS	[M-H]-	146.166	32859911
DeepCCS	[M+H]+	143.206	30932474
DeepCCS	[M-H]-	140.811	30932474
DeepCCS	[M-2H]-	175.558	30932474
DeepCCS	[M+Na]+	150.316	30932474
AllCCS	[M+H]+	156.4	32859911
AllCCS	[M+H-H2O]+	152.8	32859911
AllCCS	[M+NH4]+	159.7	32859911
AllCCS	[M+Na]+	160.6	32859911
AllCCS	[M-H]-	146.2	32859911
AllCCS	[M+Na-2H]-	146.5	32859911
AllCCS	[M+HCOO]-	146.9	32859911

Predicted Kovats Retention Indices

Underivatized

Metabolite	SMILES	Kovats RI Value	Column Type	Reference
Galactose 1-phosphate	OC[C@H]1O[C@H](OP(O)(O)=O)[C@H](O)[C@@H](O)[C@H]1O	2971.1	Standard polar	33892256
Galactose 1-phosphate	OC[C@H]1O[C@H](OP(O)(O)=O)[C@H](O)[C@@H](O)[C@H]1O	2204.1	Standard non polar	33892256
Galactose 1-phosphate	OC[C@H]1O[C@H](OP(O)(O)=O)[C@H](O)[C@@H](O)[C@H]1O	2241.4	Semi standard non polar	33892256

Derivatized

Derivative Name / Structure	SMILES	Kovats RI Value	Column Type	Reference
Galactose 1-phosphate,1TMS,isomer #1	C[Si](C)(C)OC[C@H]1O[C@H](OP(=O)(O)O)[C@H](O)[C@@H](O)[C@H]1O	2170.1	Semi standard non polar	33892256
Galactose 1-phosphate,1TMS,isomer #2	C[Si](C)(C)O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@@H]1OP(=O)(O)O	2110.0	Semi standard non polar	33892256
Galactose 1-phosphate,1TMS,isomer #3	C[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](CO)O[C@H](OP(=O)(O)O)[C@@H]1O	2104.3	Semi standard non polar	33892256
Galactose 1-phosphate,1TMS,isomer #4	C[Si](C)(C)O[C@H]1[C@@H](CO)O[C@H](OP(=O)(O)O)[C@H](O)[C@H]1O	2113.5	Semi standard non polar	33892256
Galactose 1-phosphate,1TMS,isomer #5	C[Si](C)(C)OP(=O)(O)O[C@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O	2173.1	Semi standard non polar	33892256
Galactose 1-phosphate,2TMS,isomer #1	C[Si](C)(C)OC[C@H]1O[C@H](OP(=O)(O)O)[C@H](O[Si](C)(C)C)[C@@H](O)[C@H]1O	2119.8	Semi standard non polar	33892256
Galactose 1-phosphate,2TMS,isomer #10	C[Si](C)(C)O[C@H]1[C@@H](CO)O[C@H](OP(=O)(O)O[Si](C)(C)C)[C@H](O)[C@H]1O	2153.0	Semi standard non polar	33892256
Galactose 1-phosphate,2TMS,isomer #11	C[Si](C)(C)OP(=O)(O[C@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)O[Si](C)(C)C	2194.1	Semi standard non polar	33892256
Galactose 1-phosphate,2TMS,isomer #2	C[Si](C)(C)OC[C@H]1O[C@H](OP(=O)(O)O)[C@H](O)[C@@H](O[Si](C)(C)C)[C@H]1O	2122.7	Semi standard non polar	33892256
Galactose 1-phosphate,2TMS,isomer #3	C[Si](C)(C)OC[C@H]1O[C@H](OP(=O)(O)O)[C@H](O)[C@@H](O)[C@H]1O[Si](C)(C)C	2132.5	Semi standard non polar	33892256
Galactose 1-phosphate,2TMS,isomer #4	C[Si](C)(C)OC[C@H]1O[C@H](OP(=O)(O)O[Si](C)(C)C)[C@H](O)[C@@H](O)[C@H]1O	2188.9	Semi standard non polar	33892256
Galactose 1-phosphate,2TMS,isomer #5	C[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](CO)O[C@H](OP(=O)(O)O)[C@@H]1O[Si](C)(C)C	2110.0	Semi standard non polar	33892256
Galactose 1-phosphate,2TMS,isomer #6	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H](OP(=O)(O)O)O[C@@H]1CO	2086.1	Semi standard non polar	33892256
Galactose 1-phosphate,2TMS,isomer #7	C[Si](C)(C)O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@@H]1OP(=O)(O)O[Si](C)(C)C	2162.5	Semi standard non polar	33892256
Galactose 1-phosphate,2TMS,isomer #8	C[Si](C)(C)O[C@H]1[C@@H](CO)O[C@H](OP(=O)(O)O)[C@H](O)[C@H]1O[Si](C)(C)C	2096.0	Semi standard non polar	33892256
Galactose 1-phosphate,2TMS,isomer #9	C[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](CO)O[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1O	2160.7	Semi standard non polar	33892256
Galactose 1-phosphate,3TMS,isomer #1	C[Si](C)(C)OC[C@H]1O[C@H](OP(=O)(O)O)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]1O	2124.2	Semi standard non polar	33892256
Galactose 1-phosphate,3TMS,isomer #10	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C)O[C@@H]1CO	2120.4	Semi standard non polar	33892256
Galactose 1-phosphate,3TMS,isomer #11	C[Si](C)(C)O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@@H]1OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	2116.3	Semi standard non polar	33892256
Galactose 1-phosphate,3TMS,isomer #12	C[Si](C)(C)O[C@H]1[C@@H](CO)O[C@H](OP(=O)(O)O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C	2119.5	Semi standard non polar	33892256
Galactose 1-phosphate,3TMS,isomer #13	C[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](CO)O[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1O	2124.3	Semi standard non polar	33892256
Galactose 1-phosphate,3TMS,isomer #14	C[Si](C)(C)O[C@H]1[C@@H](CO)O[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](O)[C@H]1O	2105.0	Semi standard non polar	33892256
Galactose 1-phosphate,3TMS,isomer #2	C[Si](C)(C)OC[C@H]1O[C@H](OP(=O)(O)O)[C@H](O[Si](C)(C)C)[C@@H](O)[C@H]1O[Si](C)(C)C	2123.3	Semi standard non polar	33892256
Galactose 1-phosphate,3TMS,isomer #3	C[Si](C)(C)OC[C@H]1O[C@H](OP(=O)(O)O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](O)[C@H]1O	2104.2	Semi standard non polar	33892256
Galactose 1-phosphate,3TMS,isomer #4	C[Si](C)(C)OC[C@H]1O[C@H](OP(=O)(O)O)[C@H](O)[C@@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	2118.8	Semi standard non polar	33892256
Galactose 1-phosphate,3TMS,isomer #5	C[Si](C)(C)OC[C@H]1O[C@H](OP(=O)(O)O[Si](C)(C)C)[C@H](O)[C@@H](O[Si](C)(C)C)[C@H]1O	2119.4	Semi standard non polar	33892256
Galactose 1-phosphate,3TMS,isomer #6	C[Si](C)(C)OC[C@H]1O[C@H](OP(=O)(O)O[Si](C)(C)C)[C@H](O)[C@@H](O)[C@H]1O[Si](C)(C)C	2103.6	Semi standard non polar	33892256
Galactose 1-phosphate,3TMS,isomer #7	C[Si](C)(C)OC[C@H]1O[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](O)[C@@H](O)[C@H]1O	2126.0	Semi standard non polar	33892256
Galactose 1-phosphate,3TMS,isomer #8	C[Si](C)(C)O[C@@H]1[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H](OP(=O)(O)O)O[C@@H]1CO	2126.4	Semi standard non polar	33892256
Galactose 1-phosphate,3TMS,isomer #9	C[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](CO)O[C@H](OP(=O)(O)O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	2119.6	Semi standard non polar	33892256
Galactose 1-phosphate,4TMS,isomer #1	C[Si](C)(C)OC[C@H]1O[C@H](OP(=O)(O)O)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	2139.3	Semi standard non polar	33892256
Galactose 1-phosphate,4TMS,isomer #10	C[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@@H]1CO	2186.2	Semi standard non polar	33892256
Galactose 1-phosphate,4TMS,isomer #11	C[Si](C)(C)O[C@H]1[C@@H](CO)O[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C	2185.6	Semi standard non polar	33892256
Galactose 1-phosphate,4TMS,isomer #2	C[Si](C)(C)OC[C@H]1O[C@H](OP(=O)(O)O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@H]1O	2159.3	Semi standard non polar	33892256
Galactose 1-phosphate,4TMS,isomer #3	C[Si](C)(C)OC[C@H]1O[C@H](OP(=O)(O)O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](O)[C@H]1O[Si](C)(C)C	2162.1	Semi standard non polar	33892256
Galactose 1-phosphate,4TMS,isomer #4	C[Si](C)(C)OC[C@H]1O[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](O)[C@H]1O	2128.2	Semi standard non polar	33892256
Galactose 1-phosphate,4TMS,isomer #5	C[Si](C)(C)OC[C@H]1O[C@H](OP(=O)(O)O[Si](C)(C)C)[C@H](O)[C@@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	2155.0	Semi standard non polar	33892256
Galactose 1-phosphate,4TMS,isomer #6	C[Si](C)(C)OC[C@H]1O[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](O)[C@@H](O[Si](C)(C)C)[C@H]1O	2171.7	Semi standard non polar	33892256
Galactose 1-phosphate,4TMS,isomer #7	C[Si](C)(C)OC[C@H]1O[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@H](O)[C@@H](O)[C@H]1O[Si](C)(C)C	2127.0	Semi standard non polar	33892256
Galactose 1-phosphate,4TMS,isomer #8	C[Si](C)(C)O[C@@H]1[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C)O[C@@H]1CO	2169.6	Semi standard non polar	33892256
Galactose 1-phosphate,4TMS,isomer #9	C[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](CO)O[C@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	2190.0	Semi standard non polar	33892256
Galactose 1-phosphate,5TMS,isomer #1	C[Si](C)(C)OC[C@H]1O[C@H](OP(=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	2170.2	Semi standard non polar	33892256
Galactose 1-phosphate,5TMS,isomer #1	C[Si](C)(C)OC[C@H]1O[C@H](OP(=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	2203.3	Standard non polar	33892256
Galactose 1-phosphate,5TMS,isomer #1	C[Si](C)(C)OC[C@H]1O[C@H](OP(=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	2588.2	Standard polar	33892256
Galactose 1-phosphate,5TMS,isomer #2	C[Si](C)(C)OC[C@H]1O[C@H](OP(=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	2183.8	Semi standard non polar	33892256
Galactose 1-phosphate,5TMS,isomer #2	C[Si](C)(C)OC[C@H]1O[C@H](OP(=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	2240.0	Standard non polar	33892256
Galactose 1-phosphate,5TMS,isomer #2	C[Si](C)(C)OC[C@H]1O[C@H](OP(=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	2518.6	Standard polar	33892256
Galactose 1-phosphate,5TMS,isomer #3	C[Si](C)(C)OC[C@H]1O[C@H](OP(=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	2180.4	Semi standard non polar	33892256
Galactose 1-phosphate,5TMS,isomer #3	C[Si](C)(C)OC[C@H]1O[C@H](OP(=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	2251.0	Standard non polar	33892256
Galactose 1-phosphate,5TMS,isomer #3	C[Si](C)(C)OC[C@H]1O[C@H](OP(=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	2484.5	Standard polar	33892256
Galactose 1-phosphate,5TMS,isomer #4	C[Si](C)(C)OC[C@H]1O[C@H](OP(=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	2178.4	Semi standard non polar	33892256
Galactose 1-phosphate,5TMS,isomer #4	C[Si](C)(C)OC[C@H]1O[C@H](OP(=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	2242.0	Standard non polar	33892256
Galactose 1-phosphate,5TMS,isomer #4	C[Si](C)(C)OC[C@H]1O[C@H](OP(=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	2494.6	Standard polar	33892256
Galactose 1-phosphate,5TMS,isomer #5	C[Si](C)(C)O[C@@H]1[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@@H]1CO	2194.1	Semi standard non polar	33892256
Galactose 1-phosphate,5TMS,isomer #5	C[Si](C)(C)O[C@@H]1[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@@H]1CO	2213.5	Standard non polar	33892256
Galactose 1-phosphate,5TMS,isomer #5	C[Si](C)(C)O[C@@H]1[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H](OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@@H]1CO	2475.5	Standard polar	33892256
Galactose 1-phosphate,6TMS,isomer #1	C[Si](C)(C)OC[C@H]1O[C@H](OP(=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	2220.2	Semi standard non polar	33892256
Galactose 1-phosphate,6TMS,isomer #1	C[Si](C)(C)OC[C@H]1O[C@H](OP(=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	2279.1	Standard non polar	33892256
Galactose 1-phosphate,6TMS,isomer #1	C[Si](C)(C)OC[C@H]1O[C@H](OP(=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	2440.7	Standard polar	33892256
Galactose 1-phosphate,1TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@H](OP(=O)(O)O)[C@H](O)[C@@H](O)[C@H]1O	2416.7	Semi standard non polar	33892256
Galactose 1-phosphate,1TBDMS,isomer #2	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@@H]1OP(=O)(O)O	2388.0	Semi standard non polar	33892256
Galactose 1-phosphate,1TBDMS,isomer #3	CC(C)(C)[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](CO)O[C@H](OP(=O)(O)O)[C@@H]1O	2386.8	Semi standard non polar	33892256
Galactose 1-phosphate,1TBDMS,isomer #4	CC(C)(C)[Si](C)(C)O[C@H]1[C@@H](CO)O[C@H](OP(=O)(O)O)[C@H](O)[C@H]1O	2388.0	Semi standard non polar	33892256
Galactose 1-phosphate,1TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OP(=O)(O)O[C@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O	2422.3	Semi standard non polar	33892256
Galactose 1-phosphate,2TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@H](OP(=O)(O)O)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]1O	2562.8	Semi standard non polar	33892256
Galactose 1-phosphate,2TBDMS,isomer #10	CC(C)(C)[Si](C)(C)O[C@H]1[C@@H](CO)O[C@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1O	2606.1	Semi standard non polar	33892256
Galactose 1-phosphate,2TBDMS,isomer #11	CC(C)(C)[Si](C)(C)OP(=O)(O[C@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)O[Si](C)(C)C(C)(C)C	2629.9	Semi standard non polar	33892256
Galactose 1-phosphate,2TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@H](OP(=O)(O)O)[C@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]1O	2576.9	Semi standard non polar	33892256
Galactose 1-phosphate,2TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@H](OP(=O)(O)O)[C@H](O)[C@@H](O)[C@H]1O[Si](C)(C)C(C)(C)C	2571.1	Semi standard non polar	33892256
Galactose 1-phosphate,2TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@H](O)[C@@H](O)[C@H]1O	2631.0	Semi standard non polar	33892256
Galactose 1-phosphate,2TBDMS,isomer #5	CC(C)(C)[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](CO)O[C@H](OP(=O)(O)O)[C@@H]1O[Si](C)(C)C(C)(C)C	2561.8	Semi standard non polar	33892256
Galactose 1-phosphate,2TBDMS,isomer #6	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](OP(=O)(O)O)O[C@@H]1CO	2549.3	Semi standard non polar	33892256
Galactose 1-phosphate,2TBDMS,isomer #7	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@@H]1OP(=O)(O)O[Si](C)(C)C(C)(C)C	2612.5	Semi standard non polar	33892256
Galactose 1-phosphate,2TBDMS,isomer #8	CC(C)(C)[Si](C)(C)O[C@H]1[C@@H](CO)O[C@H](OP(=O)(O)O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C	2552.5	Semi standard non polar	33892256
Galactose 1-phosphate,2TBDMS,isomer #9	CC(C)(C)[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](CO)O[C@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H]1O	2606.6	Semi standard non polar	33892256
Galactose 1-phosphate,3TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@H](OP(=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	2757.5	Semi standard non polar	33892256
Galactose 1-phosphate,3TBDMS,isomer #10	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)O[C@@H]1CO	2762.7	Semi standard non polar	33892256
Galactose 1-phosphate,3TBDMS,isomer #11	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@@H]1OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	2777.2	Semi standard non polar	33892256
Galactose 1-phosphate,3TBDMS,isomer #12	CC(C)(C)[Si](C)(C)O[C@H]1[C@@H](CO)O[C@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C	2754.8	Semi standard non polar	33892256
Galactose 1-phosphate,3TBDMS,isomer #13	CC(C)(C)[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](CO)O[C@H](OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@@H]1O	2776.1	Semi standard non polar	33892256
Galactose 1-phosphate,3TBDMS,isomer #14	CC(C)(C)[Si](C)(C)O[C@H]1[C@@H](CO)O[C@H](OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1O	2764.1	Semi standard non polar	33892256
Galactose 1-phosphate,3TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@H](OP(=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	2759.8	Semi standard non polar	33892256
Galactose 1-phosphate,3TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@H](OP(=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	2785.7	Semi standard non polar	33892256
Galactose 1-phosphate,3TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@H](OP(=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	2741.7	Semi standard non polar	33892256
Galactose 1-phosphate,3TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@H](OP(=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	2784.7	Semi standard non polar	33892256
Galactose 1-phosphate,3TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@H](OP(=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	2775.7	Semi standard non polar	33892256
Galactose 1-phosphate,3TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@H](OP(=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	2788.5	Semi standard non polar	33892256
Galactose 1-phosphate,3TBDMS,isomer #8	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](OP(=O)(O)O)O[C@@H]1CO	2745.2	Semi standard non polar	33892256
Galactose 1-phosphate,3TBDMS,isomer #9	CC(C)(C)[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](CO)O[C@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)[C@@H]1O[Si](C)(C)C(C)(C)C	2767.1	Semi standard non polar	33892256
Galactose 1-phosphate,4TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@H](OP(=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	2970.8	Semi standard non polar	33892256
Galactose 1-phosphate,4TBDMS,isomer #10	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)O[C@@H]1CO	2977.4	Semi standard non polar	33892256
Galactose 1-phosphate,4TBDMS,isomer #11	CC(C)(C)[Si](C)(C)O[C@H]1[C@@H](CO)O[C@H](OP(=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	2971.3	Semi standard non polar	33892256
Galactose 1-phosphate,4TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@H](OP(=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	2974.6	Semi standard non polar	33892256
Galactose 1-phosphate,4TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@H](OP(=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	2976.5	Semi standard non polar	33892256
Galactose 1-phosphate,4TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@H](OP(=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	2970.7	Semi standard non polar	33892256
Galactose 1-phosphate,4TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@H](OP(=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	2970.0	Semi standard non polar	33892256
Galactose 1-phosphate,4TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@H](OP(=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	2972.7	Semi standard non polar	33892256
Galactose 1-phosphate,4TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@H](OP(=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	2958.4	Semi standard non polar	33892256
Galactose 1-phosphate,4TBDMS,isomer #8	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](OP(=O)(O)O[Si](C)(C)C(C)(C)C)O[C@@H]1CO	2971.2	Semi standard non polar	33892256
Galactose 1-phosphate,4TBDMS,isomer #9	CC(C)(C)[Si](C)(C)O[C@H]1[C@@H](O)[C@@H](CO)O[C@H](OP(=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	2974.5	Semi standard non polar	33892256
Galactose 1-phosphate,5TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@H](OP(=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	3192.1	Semi standard non polar	33892256
Galactose 1-phosphate,5TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@H](OP(=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	3106.6	Standard non polar	33892256
Galactose 1-phosphate,5TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@H](OP(=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	3022.0	Standard polar	33892256
Galactose 1-phosphate,5TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@H](OP(=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	3184.1	Semi standard non polar	33892256
Galactose 1-phosphate,5TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@H](OP(=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	3104.0	Standard non polar	33892256
Galactose 1-phosphate,5TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@H](OP(=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	2980.3	Standard polar	33892256
Galactose 1-phosphate,5TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@H](OP(=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	3185.9	Semi standard non polar	33892256
Galactose 1-phosphate,5TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@H](OP(=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	3118.0	Standard non polar	33892256
Galactose 1-phosphate,5TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@H](OP(=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	2953.5	Standard polar	33892256
Galactose 1-phosphate,5TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@H](OP(=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	3177.0	Semi standard non polar	33892256
Galactose 1-phosphate,5TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@H](OP(=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	3102.5	Standard non polar	33892256
Galactose 1-phosphate,5TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@H](OP(=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	2965.1	Standard polar	33892256
Galactose 1-phosphate,5TBDMS,isomer #5	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)O[C@@H]1CO	3186.2	Semi standard non polar	33892256
Galactose 1-phosphate,5TBDMS,isomer #5	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)O[C@@H]1CO	3085.0	Standard non polar	33892256
Galactose 1-phosphate,5TBDMS,isomer #5	CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)O[C@@H]1CO	2943.0	Standard polar	33892256

Spectra

GC-MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Predicted GC-MS	Predicted GC-MS Spectrum - Galactose 1-phosphate GC-MS (Non-derivatized) - 70eV, Positive	splash10-0002-9110000000-ee60e23a7f8053dae6d3	2016-09-22	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Galactose 1-phosphate GC-MS (4 TMS) - 70eV, Positive	splash10-0fsi-5901370000-80b5e0114d382bd45e3f	2017-10-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Galactose 1-phosphate GC-MS (Non-derivatized) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Galactose 1-phosphate GC-MS (Non-derivatized) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Galactose 1-phosphate GC-MS (TMS_1_1) - 70eV, Positive	Not Available	2021-11-05	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Galactose 1-phosphate GC-MS (TMS_1_2) - 70eV, Positive	Not Available	2021-11-05	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Galactose 1-phosphate GC-MS (TMS_1_3) - 70eV, Positive	Not Available	2021-11-05	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Galactose 1-phosphate GC-MS (TMS_1_4) - 70eV, Positive	Not Available	2021-11-05	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Galactose 1-phosphate GC-MS (TMS_1_5) - 70eV, Positive	Not Available	2021-11-05	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Galactose 1-phosphate GC-MS (TMS_2_1) - 70eV, Positive	Not Available	2021-11-05	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Galactose 1-phosphate GC-MS (TMS_2_2) - 70eV, Positive	Not Available	2021-11-05	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Galactose 1-phosphate GC-MS (TMS_2_3) - 70eV, Positive	Not Available	2021-11-05	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Galactose 1-phosphate GC-MS (TMS_2_4) - 70eV, Positive	Not Available	2021-11-05	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Galactose 1-phosphate GC-MS (TMS_2_5) - 70eV, Positive	Not Available	2021-11-05	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Galactose 1-phosphate GC-MS (TMS_2_6) - 70eV, Positive	Not Available	2021-11-05	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Galactose 1-phosphate GC-MS (TMS_2_7) - 70eV, Positive	Not Available	2021-11-05	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Galactose 1-phosphate GC-MS (TMS_2_8) - 70eV, Positive	Not Available	2021-11-05	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Galactose 1-phosphate GC-MS (TMS_2_9) - 70eV, Positive	Not Available	2021-11-05	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Galactose 1-phosphate GC-MS (TMS_2_10) - 70eV, Positive	Not Available	2021-11-05	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Galactose 1-phosphate GC-MS (TMS_2_11) - 70eV, Positive	Not Available	2021-11-05	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Galactose 1-phosphate GC-MS (TMS_3_1) - 70eV, Positive	Not Available	2021-11-05	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Galactose 1-phosphate GC-MS (TMS_3_2) - 70eV, Positive	Not Available	2021-11-05	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Galactose 1-phosphate GC-MS (TMS_3_3) - 70eV, Positive	Not Available	2021-11-05	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Galactose 1-phosphate GC-MS (TMS_3_4) - 70eV, Positive	Not Available	2021-11-05	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Galactose 1-phosphate GC-MS (TMS_3_5) - 70eV, Positive	Not Available	2021-11-05	Wishart Lab	View Spectrum

MS/MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Experimental LC-MS/MS	LC-MS/MS Spectrum - Galactose 1-phosphate LC-ESI-QTOF , negative-QTOF	splash10-004i-9030000000-7fff706c8ccfa4e8ee82	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Galactose 1-phosphate LC-ESI-QTOF , negative-QTOF	splash10-004i-9030000000-7ea4c16f3c1f90045b95	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Galactose 1-phosphate , negative-QTOF	splash10-0002-9000000000-d23bc07bd7bdf7ddce46	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Galactose 1-phosphate n/a 18V, positive-QTOF	splash10-03dl-1970000000-880e9f60970f0816b8c4	2020-07-22	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Galactose 1-phosphate n/a 18V, positive-QTOF	splash10-001i-0920000000-2cbd9f1121176bb271ef	2020-07-22	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Galactose 1-phosphate Orbitrap 1V, positive-QTOF	splash10-0002-0090000000-f7a9704c507f87576963	2020-07-22	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Galactose 1-phosphate Orbitrap 2V, positive-QTOF	splash10-0002-0190000000-190752fd0e6fc6923351	2020-07-22	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Galactose 1-phosphate Orbitrap 4V, positive-QTOF	splash10-0f72-0490000000-14a970b0e103aee3ac86	2020-07-22	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Galactose 1-phosphate Orbitrap 5V, positive-QTOF	splash10-000i-0950000000-791dd70d946defe0237d	2020-07-22	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Galactose 1-phosphate Orbitrap 3V, positive-QTOF	splash10-001r-0890000000-7333cc4fec9c480da18b	2020-07-22	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Galactose 1-phosphate Orbitrap 5V, positive-QTOF	splash10-000i-0920000000-b0116f36e8c1774e674f	2020-07-22	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Galactose 1-phosphate n/a 18V, positive-QTOF	splash10-000i-0900000000-ce07a8268e9be0a752ea	2020-07-22	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Galactose 1-phosphate n/a 18V, positive-QTOF	splash10-004l-9000000000-771382b82d73a025b900	2020-07-22	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Galactose 1-phosphate n/a 18V, positive-QTOF	splash10-03di-0900000000-75b95578eec10c7fb1a0	2020-07-22	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Galactose 1-phosphate n/a 18V, positive-QTOF	splash10-00di-0900000000-efd4d199381342fcfd6e	2020-07-22	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Galactose 1-phosphate n/a 18V, positive-QTOF	splash10-014i-0900000000-59a34fd931d5d3eb02ad	2020-07-22	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Galactose 1-phosphate n/a 18V, positive-QTOF	splash10-0f6t-0290000000-e0994816c9da10e9884b	2020-07-22	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Galactose 1-phosphate n/a 18V, positive-QTOF	splash10-004i-0190000000-0871936f57509fe1ab16	2020-07-22	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Galactose 1-phosphate Orbitrap 7V, positive-QTOF	splash10-00di-0049000000-b5229bec94bbe9e0fe04	2020-07-22	HMDB team, MONA	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Galactose 1-phosphate 10V, Positive-QTOF	splash10-0002-9240000000-4057005941a73b47e92b	2015-09-15	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Galactose 1-phosphate 20V, Positive-QTOF	splash10-0002-9240000000-2b520b8d7520453613e5	2015-09-15	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Galactose 1-phosphate 40V, Positive-QTOF	splash10-0002-9100000000-adafd3ed58bf5371e4a1	2015-09-15	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Galactose 1-phosphate 10V, Negative-QTOF	splash10-0a6s-9480000000-6d21f499da6e13bbe38d	2015-09-15	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Galactose 1-phosphate 20V, Negative-QTOF	splash10-004i-9110000000-68aeffe1ebca2d4d4362	2015-09-15	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Galactose 1-phosphate 40V, Negative-QTOF	splash10-004i-9000000000-dfc211275bafe42581ae	2015-09-15	Wishart Lab	View Spectrum

NMR Spectra

Spectrum Type	Description	Deposition Date	Source	View
Predicted 1D NMR	¹H NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum

Biological Properties

Cellular Locations

Cytoplasm (predicted from logP)

Biospecimen Locations

Blood

Tissue Locations

Erythrocyte
Placenta

Pathways

Name	SMPDB/PathBank	KEGG
Nucleotide Sugars Metabolism
Lactose Synthesis		Not Available
Galactose Metabolism
Galactosemia II (GALK)		Not Available
Galactosemia III		Not Available

Normal Concentrations

Biospecimen	Status	Value	Age	Sex	Condition	Reference	Details
Blood	Detected and Quantified	31.0 (0.0-57.0) uM	Children (1-13 years old)	Both	Normal	Geigy Scientific ...	details
Blood	Detected and Quantified	65.0 +/- 31.0 uM	Newborn (0-30 days old)	Both	Normal	Geigy Scientific ...	details

Abnormal Concentrations

Not Available

Associated Disorders and Diseases

Disease References

None

Associated OMIM IDs

None

External Links

DrugBank ID

DB02317

Phenol Explorer Compound ID

Not Available

FooDB ID

FDB001159

KNApSAcK ID

C00007391

Chemspider ID

Not Available

KEGG Compound ID

C00446

BioCyc ID

GALACTOSE-1P

BiGG ID

Not Available

Wikipedia Link

Galactose_1-phosphate

METLIN ID

Not Available

PubChem Compound

123912

PDB ID

Not Available

ChEBI ID

17973

Food Biomarker Ontology

Not Available

VMH ID

Not Available

MarkerDB ID

Not Available

Good Scents ID

Not Available

References

Synthesis Reference

Chen Jie; Yager Claire; Reynolds Robert; Palmieri Michael; Segal Stanton Erythrocyte galactose 1-phosphate quantified by isotope-dilution gas chromatography-mass spectrometry. Clinical chemistry (2002), 48(4), 604-12.

Material Safety Data Sheet (MSDS)

Not Available

General References

Ning C, Reynolds R, Chen J, Yager C, Berry GT, McNamara PD, Leslie N, Segal S: Galactose metabolism by the mouse with galactose-1-phosphate uridyltransferase deficiency. Pediatr Res. 2000 Aug;48(2):211-7. [PubMed:10926297 ]
Berry GT, Palmieri M, Gross KC, Acosta PB, Henstenburg JA, Mazur A, Reynolds R, Segal S: The effect of dietary fruits and vegetables on urinary galactitol excretion in galactose-1-phosphate uridyltransferase deficiency. J Inherit Metab Dis. 1993;16(1):91-100. [PubMed:8487507 ]
Ono H, Mawatari H, Mizoguchi N, Eguchi T, Sakura N, Hamakawa M: Transient galactosemia detected by neonatal mass screening. Pediatr Int. 1999 Jun;41(3):281-4. [PubMed:10365579 ]
Endres W: Inherited metabolic diseases affecting the carrier. J Inherit Metab Dis. 1997 Mar;20(1):9-20. [PubMed:9061562 ]
Guerrero NV, Singh RH, Manatunga A, Berry GT, Steiner RD, Elsas LJ 2nd: Risk factors for premature ovarian failure in females with galactosemia. J Pediatr. 2000 Dec;137(6):833-41. [PubMed:11113841 ]
Schaub J, Remberger K, Endres W, Bremer HJ: Galactosemia with endogenous production of galactose-1-phosphate and with cystic fibrosis-like appearance at autopsy. Helv Paediatr Acta. 1976 Jun;31(1):67-76. [PubMed:939702 ]
Bozkowa K, Zbieg-Sendecka E, Grodzka Z, Cabalska B: [Clinical and biochemical diagnosis of galactosemia among our cases]. Probl Med Wieku Rozwoj. 1979;8:63-9. [PubMed:263527 ]
Dahlqvist A: A fluorometric method for the assay of galactose-1-phosphate in red blood cells. J Lab Clin Med. 1971 Dec;78(6):931-8. [PubMed:5131857 ]
Bozkowa K, Duchnowska A, Chojnacki T, Mankowski T: [New radioisotope method of quantitative determination of galactose-1-phosphate in red blood cells in galactosemia]. Pol Tyg Lek. 1975 Dec 22;30(51):2123-6. [PubMed:1197109 ]
Wharton CH, Berry HK, Bofinger MK: Galactose-1-phosphate accumulation by a Duarte-transferase deficiency double heterozygote. Clin Genet. 1978 Feb;13(2):171-5. [PubMed:627109 ]
Gitzelmann R, Steinmann B, Mitchell B, Haigis E: Uridine diphosphate galactose 4'-epimerase deficiency. IV. Report of eight cases in three families. Helv Paediatr Acta. 1977 Apr;31(6):441-52. [PubMed:404274 ]
Barbouth D, Slepak T, Klapper H, Lai K, Elsas LJ: Prevention of a molecular misdiagnosis in galactosemia. Genet Med. 2006 Mar;8(3):178-82. [PubMed:16540753 ]
Mankowski T, Radomyska B, Zbieg-Sendecka E: Preliminary results of UDP galactose pyrophosphorylase in the erythrocytes of healthy persons and in patients with galactosaemia. Mater Med Pol. 1990 Jul-Sep;22(3):191-3. [PubMed:2132425 ]
Moller HE, Ullrich K, Vermathen P, Schuierer G, Koch HG: In vivo study of brain metabolism in galactosemia by 1H and 31P magnetic resonance spectroscopy. Eur J Pediatr. 1995;154(7 Suppl 2):S8-13. [PubMed:7671972 ]
Barth CA, Kopra N: Oral intake of glucose plus galactose and erythrocyte galactose-1-phosphate. A nutritional evaluation of hydrolyzed lactose. Z Ernahrungswiss. 1986 Sep;25(3):171-9. [PubMed:3776241 ]
Pesce MA, Bodourian SH: Clinical significance of plasma galactose and erythrocyte galactose-1-phosphate measurements in transferase-deficient galactosemia and in individuals with below-normal transferase activity. Clin Chem. 1982 Feb;28(2):301-5. [PubMed:6276048 ]
Schadewaldt P, Kamalanathan L, Hammen HW, Wendel U: Age dependence of endogenous galactose formation in Q188R homozygous galactosemic patients. Mol Genet Metab. 2004 Jan;81(1):31-44. [PubMed:14728989 ]
Pesce MA, Bodourian SH, Nicholson JF: A new microfluorometric method for the measurement of galactose-1-phosphate in erythrocytes. Clin Chim Acta. 1982 Feb 5;118(2-3):177-89. [PubMed:7055979 ]
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 ]
Gitzelmann R: Galactose-1-phosphate in the pathophysiology of galactosemia. Eur J Pediatr. 1995;154(7 Suppl 2):S45-9. doi: 10.1007/BF02143803. [PubMed:7671964 ]
McCorvie TJ, Gleason TJ, Fridovich-Keil JL, Timson DJ: Misfolding of galactose 1-phosphate uridylyltransferase can result in type I galactosemia. Biochim Biophys Acta. 2013 Aug;1832(8):1279-93. doi: 10.1016/j.bbadis.2013.04.004. Epub 2013 Apr 11. [PubMed:23583749 ]

Enzymes

Enzyme Details

1. Galactose-1-phosphate uridylyltransferase

General function:: Involved in UDP-glucose:hexose-1-phosphate uridylyltransferase activity
Specific function:: Not Available
Gene Name:: GALT
Uniprot ID:: P07902
Molecular weight:: 43362.83

Reactions

Uridine diphosphate glucose + Galactose 1-phosphate → Glucose 1-phosphate + Uridine diphosphategalactose	details

Enzyme Details

2. N-acetylgalactosamine kinase

General function:: Involved in galactokinase activity
Specific function:: Acts on GalNAc. Also acts as a galactokinase when galactose is present at high concentrations. May be involved in a salvage pathway for the reutilization of free GalNAc derived from the degradation of complex carbohydrates.
Gene Name:: GALK2
Uniprot ID:: Q01415
Molecular weight:: 49234.57

Reactions

Adenosine triphosphate + beta-D-Galactose → ADP + Galactose 1-phosphate	details

Enzyme Details

3. Galactokinase

General function:: Involved in galactokinase activity
Specific function:: Major enzyme for galactose metabolism.
Gene Name:: GALK1
Uniprot ID:: P51570
Molecular weight:: 42271.805

Reactions

Adenosine triphosphate + beta-D-Galactose → ADP + Galactose 1-phosphate	details

Showing metabocard for Galactose 1-phosphate (HMDB0000645)

MOL for HMDB0000645 (Galactose 1-phosphate)

3D MOL for HMDB0000645 (Galactose 1-phosphate)

3D SDF for HMDB0000645 (Galactose 1-phosphate)

3D-SDF for HMDB0000645 (Galactose 1-phosphate)

PDB for HMDB0000645 (Galactose 1-phosphate)

3D PDB for HMDB0000645 (Galactose 1-phosphate)

SMILES for HMDB0000645 (Galactose 1-phosphate)

INCHI for HMDB0000645 (Galactose 1-phosphate)

Structure for HMDB0000645 (Galactose 1-phosphate)

3D Structure for HMDB0000645 (Galactose 1-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