MiMeDB: Showing metabocard for N-Acetyl-glucosamine 1-phosphate (MMDBc0029632)

Microbial

Record Information

Version

2.0

Status

Detected and Quantified

Creation Date

2021-11-17 23:35:24 UTC

Update Date

2024-04-30 19:39:48 UTC

Metabolite ID

MMDBc0029632

Metabolite Identification

Common Name

N-Acetyl-glucosamine 1-phosphate

Description

N-acetyl-glucosamine 1-phosphate is a member of the chemical class known as N-acetyl-alpha-hexosamine-1-phosphates. These are carbohydrates derivative which is structurally characterized by the presence of an hexosamine bearing a phosphate group attached to the C1 carbon atom, and another moeity N-linked through the amine group.

Structure

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

HMDB0001367
     RDKit          3D
N-Acetyl-glucosamine 1-phosphate
 35 35  0  0  0  0  0  0  0  0999 V2000
    4.2533    0.0640    0.0190 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0160   -0.7044   -0.1374 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0343   -1.9567   -0.2576 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7731   -0.0464   -0.1558 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.5000   -0.7267   -0.3059 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.3320   -0.3637    0.8984 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1893    0.9972    1.1155 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4894    1.3679    2.5988 P   0  0  0  0  0  5  0  0  0  0  0  0
   -0.4651    2.2304    3.4177 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9016    2.2736    2.3839 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8605    0.0061    3.5165 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6788   -0.6454    0.7331 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1755    0.0723   -0.3608 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.6793    0.0799   -0.3972 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2243   -1.1766   -0.4869 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5755   -0.5814   -1.5885 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.2326   -0.2346   -2.7506 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1186   -0.1780   -1.5945 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.5764   -0.6455   -2.6753 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3680    0.4653    1.0449 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1160   -0.5928   -0.2068 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2017    0.9292   -0.6907 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7096    1.0076   -0.0578 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6633   -1.8259   -0.4016 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0279   -0.9840    1.7454 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7617    2.8000    1.5443 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5178    0.2383    4.2110 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7786    1.1021   -0.2552 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9790    0.7211   -1.2520 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0167    0.6177    0.5205 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0558   -1.1128   -1.0567 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5889   -1.6978   -1.4377 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6674   -1.0442   -3.1158 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0766    0.9373   -1.4904 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0634   -1.3928   -3.0736 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  2  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  2  0
  8 10  1  0
  8 11  1  0
  6 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  1  0
 13 16  1  0
 16 17  1  0
 16 18  1  0
 18 19  1  0
 18  5  1  0
  1 20  1  0
  1 21  1  0
  1 22  1  0
  4 23  1  0
  5 24  1  6
  6 25  1  0
 10 26  1  0
 11 27  1  0
 13 28  1  1
 14 29  1  0
 14 30  1  0
 15 31  1  0
 16 32  1  1
 17 33  1  0
 18 34  1  1
 19 35  1  0
M  END


  Mrv0541 02231219052D          

 19 19  0  0  1  0            999 V2000
    0.0946   -0.6850    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.0946    0.1400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6245   -1.0975    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.0596   -1.1127    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6245    0.5525    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8061    0.5525    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3397   -0.6850    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.6245   -1.9188    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7712   -0.7001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3397    0.1400    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.8061    1.3776    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0437   -1.0975    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4827   -1.1127    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7673    0.1211    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0437    0.5525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8061    2.1989    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6311    1.3776    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0151    1.3776    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6719    0.0189    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
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  1  1  0  0  0
  4  9  1  0  0  0  0
  5 10  1  0  0  0  0
  6 11  1  0  0  0  0
  7 12  1  6  0  0  0
  9 13  1  0  0  0  0
  9 14  2  0  0  0  0
 10 15  1  1  0  0  0
 11 16  1  0  0  0  0
 11 17  1  0  0  0  0
 11 18  2  0  0  0  0
 15 19  1  0  0  0  0
  7 10  1  0  0  0  0
M  END
> <DATABASE_ID>
MMDBc0029632

> <DATABASE_NAME>
MIME

> <SMILES>
CC(=O)N[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)OC1OP(O)(O)=O

> <INCHI_IDENTIFIER>
InChI=1S/C8H16NO9P/c1-3(11)9-5-7(13)6(12)4(2-10)17-8(5)18-19(14,15)16/h4-8,10,12-13H,2H2,1H3,(H,9,11)(H2,14,15,16)/t4-,5-,6-,7-,8?/m1/s1

> <INCHI_KEY>
FZLJPEPAYPUMMR-RTRLPJTCSA-N

> <FORMULA>
C8H16NO9P

> <MOLECULAR_WEIGHT>
301.1877

> <EXACT_MASS>
301.056267627

> <JCHEM_ACCEPTOR_COUNT>
8

> <JCHEM_AVERAGE_POLARIZABILITY>
25.406552682510437

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
6

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

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

> <ALOGPS_LOGP>
-2.00

> <JCHEM_LOGP>
-3.3441404429999997

> <ALOGPS_LOGS>
-1.21

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
1

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-2

> <JCHEM_PKA>
6.238176832880029

> <JCHEM_PKA_STRONGEST_ACIDIC>
1.1819802553665197

> <JCHEM_PKA_STRONGEST_BASIC>
-0.7889787416026043

> <JCHEM_POLAR_SURFACE_AREA>
165.78

> <JCHEM_REFRACTIVITY>
57.8976

> <JCHEM_ROTATABLE_BOND_COUNT>
4

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
1.84e+01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
[(3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphosphonic acid

> <JCHEM_VEBER_RULE>
0

$$$$

HMDB0001367
     RDKit          3D
N-Acetyl-glucosamine 1-phosphate
 35 35  0  0  0  0  0  0  0  0999 V2000
    4.2533    0.0640    0.0190 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0160   -0.7044   -0.1374 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0343   -1.9567   -0.2576 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7731   -0.0464   -0.1558 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.5000   -0.7267   -0.3059 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.3320   -0.3637    0.8984 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1893    0.9972    1.1155 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4894    1.3679    2.5988 P   0  0  0  0  0  5  0  0  0  0  0  0
   -0.4651    2.2304    3.4177 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9016    2.2736    2.3839 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8605    0.0061    3.5165 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6788   -0.6454    0.7331 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1755    0.0723   -0.3608 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.6793    0.0799   -0.3972 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2243   -1.1766   -0.4869 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5755   -0.5814   -1.5885 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.2326   -0.2346   -2.7506 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1186   -0.1780   -1.5945 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.5764   -0.6455   -2.6753 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3680    0.4653    1.0449 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1160   -0.5928   -0.2068 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2017    0.9292   -0.6907 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7096    1.0076   -0.0578 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6633   -1.8259   -0.4016 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0279   -0.9840    1.7454 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7617    2.8000    1.5443 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5178    0.2383    4.2110 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7786    1.1021   -0.2552 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9790    0.7211   -1.2520 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0167    0.6177    0.5205 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0558   -1.1128   -1.0567 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5889   -1.6978   -1.4377 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6674   -1.0442   -3.1158 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0766    0.9373   -1.4904 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0634   -1.3928   -3.0736 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  2  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  2  0
  8 10  1  0
  8 11  1  0
  6 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  1  0
 13 16  1  0
 16 17  1  0
 16 18  1  0
 18 19  1  0
 18  5  1  0
  1 20  1  0
  1 21  1  0
  1 22  1  0
  4 23  1  0
  5 24  1  6
  6 25  1  0
 10 26  1  0
 11 27  1  0
 13 28  1  1
 14 29  1  0
 14 30  1  0
 15 31  1  0
 16 32  1  1
 17 33  1  0
 18 34  1  1
 19 35  1  0
M  END

HEADER    PROTEIN                                 23-FEB-12   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   23-FEB-12         0                                  
HETATM    1  C   UNK     0       0.177  -1.279   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       0.177   0.261   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      -1.166  -2.049   0.000  0.00  0.00           C+0
HETATM    4  N   UNK     0       1.978  -2.077   0.000  0.00  0.00           N+0
HETATM    5  O   UNK     0      -1.166   1.031   0.000  0.00  0.00           O+0
HETATM    6  O   UNK     0       1.505   1.031   0.000  0.00  0.00           O+0
HETATM    7  C   UNK     0      -2.501  -1.279   0.000  0.00  0.00           C+0
HETATM    8  O   UNK     0      -1.166  -3.582   0.000  0.00  0.00           O+0
HETATM    9  C   UNK     0       3.306  -1.307   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      -2.501   0.261   0.000  0.00  0.00           C+0
HETATM   11  P   UNK     0       1.505   2.572   0.000  0.00  0.00           P+0
HETATM   12  O   UNK     0      -3.815  -2.049   0.000  0.00  0.00           O+0
HETATM   13  C   UNK     0       4.634  -2.077   0.000  0.00  0.00           C+0
HETATM   14  O   UNK     0       3.299   0.226   0.000  0.00  0.00           O+0
HETATM   15  C   UNK     0      -3.815   1.031   0.000  0.00  0.00           C+0
HETATM   16  O   UNK     0       1.505   4.105   0.000  0.00  0.00           O+0
HETATM   17  O   UNK     0       3.045   2.572   0.000  0.00  0.00           O+0
HETATM   18  O   UNK     0      -0.028   2.572   0.000  0.00  0.00           O+0
HETATM   19  O   UNK     0      -4.988   0.035   0.000  0.00  0.00           O+0
CONECT    1    2    3    4                                                  
CONECT    2    1    5    6                                                  
CONECT    3    1    7    8                                                  
CONECT    4    1    9                                                       
CONECT    5    2   10                                                       
CONECT    6    2   11                                                       
CONECT    7    3   12   10                                                  
CONECT    8    3                                                            
CONECT    9    4   13   14                                                  
CONECT   10    5   15    7                                                  
CONECT   11    6   16   17   18                                             
CONECT   12    7                                                            
CONECT   13    9                                                            
CONECT   14    9                                                            
CONECT   15   10   19                                                       
CONECT   16   11                                                            
CONECT   17   11                                                            
CONECT   18   11                                                            
CONECT   19   15                                                            
MASTER        0    0    0    0    0    0    0    0   19    0   38    0
END

COMPND    HMDB0001367
HETATM    1  C1  UNL     1       4.253   0.064   0.019  1.00  0.00           C  
HETATM    2  C2  UNL     1       3.016  -0.704  -0.137  1.00  0.00           C  
HETATM    3  O1  UNL     1       3.034  -1.957  -0.258  1.00  0.00           O  
HETATM    4  N1  UNL     1       1.773  -0.046  -0.156  1.00  0.00           N  
HETATM    5  C3  UNL     1       0.500  -0.727  -0.306  1.00  0.00           C  
HETATM    6  C4  UNL     1      -0.332  -0.364   0.898  1.00  0.00           C  
HETATM    7  O2  UNL     1      -0.189   0.997   1.116  1.00  0.00           O  
HETATM    8  P1  UNL     1       0.489   1.368   2.599  1.00  0.00           P  
HETATM    9  O3  UNL     1      -0.465   2.230   3.418  1.00  0.00           O  
HETATM   10  O4  UNL     1       1.902   2.274   2.384  1.00  0.00           O  
HETATM   11  O5  UNL     1       0.861   0.006   3.516  1.00  0.00           O  
HETATM   12  O6  UNL     1      -1.679  -0.645   0.733  1.00  0.00           O  
HETATM   13  C5  UNL     1      -2.175   0.072  -0.361  1.00  0.00           C  
HETATM   14  C6  UNL     1      -3.679   0.080  -0.397  1.00  0.00           C  
HETATM   15  O7  UNL     1      -4.224  -1.177  -0.487  1.00  0.00           O  
HETATM   16  C7  UNL     1      -1.575  -0.581  -1.589  1.00  0.00           C  
HETATM   17  O8  UNL     1      -2.233  -0.235  -2.751  1.00  0.00           O  
HETATM   18  C8  UNL     1      -0.119  -0.178  -1.594  1.00  0.00           C  
HETATM   19  O9  UNL     1       0.576  -0.646  -2.675  1.00  0.00           O  
HETATM   20  H1  UNL     1       4.368   0.465   1.045  1.00  0.00           H  
HETATM   21  H2  UNL     1       5.116  -0.593  -0.207  1.00  0.00           H  
HETATM   22  H3  UNL     1       4.202   0.929  -0.691  1.00  0.00           H  
HETATM   23  H4  UNL     1       1.710   1.008  -0.058  1.00  0.00           H  
HETATM   24  H5  UNL     1       0.663  -1.826  -0.402  1.00  0.00           H  
HETATM   25  H6  UNL     1       0.028  -0.984   1.745  1.00  0.00           H  
HETATM   26  H7  UNL     1       1.762   2.800   1.544  1.00  0.00           H  
HETATM   27  H8  UNL     1       1.518   0.238   4.211  1.00  0.00           H  
HETATM   28  H9  UNL     1      -1.779   1.102  -0.255  1.00  0.00           H  
HETATM   29  H10 UNL     1      -3.979   0.721  -1.252  1.00  0.00           H  
HETATM   30  H11 UNL     1      -4.017   0.618   0.520  1.00  0.00           H  
HETATM   31  H12 UNL     1      -5.056  -1.113  -1.057  1.00  0.00           H  
HETATM   32  H13 UNL     1      -1.589  -1.698  -1.438  1.00  0.00           H  
HETATM   33  H14 UNL     1      -2.667  -1.044  -3.116  1.00  0.00           H  
HETATM   34  H15 UNL     1      -0.077   0.937  -1.490  1.00  0.00           H  
HETATM   35  H16 UNL     1       0.063  -1.393  -3.074  1.00  0.00           H  
CONECT    1    2   20   21   22
CONECT    2    3    3    4
CONECT    4    5   23
CONECT    5    6   18   24
CONECT    6    7   12   25
CONECT    7    8
CONECT    8    9    9   10   11
CONECT   10   26
CONECT   11   27
CONECT   12   13
CONECT   13   14   16   28
CONECT   14   15   29   30
CONECT   15   31
CONECT   16   17   18   32
CONECT   17   33
CONECT   18   19   34
CONECT   19   35
END

HMDB0001367
     RDKit          3D
N-Acetyl-glucosamine 1-phosphate
 35 35  0  0  0  0  0  0  0  0999 V2000
    4.2533    0.0640    0.0190 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0160   -0.7044   -0.1374 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0343   -1.9567   -0.2576 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7731   -0.0464   -0.1558 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.5000   -0.7267   -0.3059 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.3320   -0.3637    0.8984 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1893    0.9972    1.1155 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4894    1.3679    2.5988 P   0  0  0  0  0  5  0  0  0  0  0  0
   -0.4651    2.2304    3.4177 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9016    2.2736    2.3839 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8605    0.0061    3.5165 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6788   -0.6454    0.7331 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1755    0.0723   -0.3608 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.6793    0.0799   -0.3972 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2243   -1.1766   -0.4869 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5755   -0.5814   -1.5885 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.2326   -0.2346   -2.7506 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1186   -0.1780   -1.5945 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.5764   -0.6455   -2.6753 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3680    0.4653    1.0449 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1160   -0.5928   -0.2068 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2017    0.9292   -0.6907 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7096    1.0076   -0.0578 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6633   -1.8259   -0.4016 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0279   -0.9840    1.7454 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7617    2.8000    1.5443 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5178    0.2383    4.2110 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7786    1.1021   -0.2552 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9790    0.7211   -1.2520 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0167    0.6177    0.5205 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0558   -1.1128   -1.0567 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5889   -1.6978   -1.4377 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6674   -1.0442   -3.1158 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0766    0.9373   -1.4904 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0634   -1.3928   -3.0736 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  2  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  2  0
  8 10  1  0
  8 11  1  0
  6 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  1  0
 13 16  1  0
 16 17  1  0
 16 18  1  0
 18 19  1  0
 18  5  1  0
  1 20  1  0
  1 21  1  0
  1 22  1  0
  4 23  1  0
  5 24  1  6
  6 25  1  0
 10 26  1  0
 11 27  1  0
 13 28  1  1
 14 29  1  0
 14 30  1  0
 15 31  1  0
 16 32  1  1
 17 33  1  0
 18 34  1  1
 19 35  1  0
M  END

Synonyms

Value	Source
2-(Acetylamino)-2-deoxy-D-glucopyranose 1-(dihydrogen phosphate)	ChEBI
2-Acetamido-2-deoxy-1-O-phosphono-D-glucopyranose	ChEBI
N-Acetyl-D-glucosamine 1-phosphate	ChEBI
N-Acetylglucosamine-1-phosphate	ChEBI
2-(Acetylamino)-2-deoxy-D-glucopyranose 1-(dihydrogen phosphoric acid)	Generator
N-Acetyl-D-glucosamine 1-phosphoric acid	Generator
N-Acetylglucosamine-1-phosphoric acid	Generator
N-Acetyl-glucosamine 1-phosphoric acid	Generator
D-Glucosamine 1-phosphate	HMDB
delta-Glucosamine 1-phosphate	HMDB
N-Acetyl-alpha-D-glucosamine 1-phosphate	HMDB
N-Acetyl-alpha-delta-glucosamine 1-phosphate	HMDB
N-Acetyl-delta-glucosamine 1-phosphate	HMDB
N-Acetyl-glucosamine-1-phosphate	HMDB
GlcNAc-1-phosphate	HMDB

Molecular Formula

C₈H₁₆NO₉P

Average Mass

301.1877

Monoisotopic Mass

301.056267627

IUPAC Name

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

Traditional Name

[(3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphosphonic acid

CAS Registry Number

Not Available

SMILES

CC(=O)N[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)OC1OP(O)(O)=O

InChI Identifier

InChI=1S/C8H16NO9P/c1-3(11)9-5-7(13)6(12)4(2-10)17-8(5)18-19(14,15)16/h4-8,10,12-13H,2H2,1H3,(H,9,11)(H2,14,15,16)/t4-,5-,6-,7-,8?/m1/s1

InChI Key

FZLJPEPAYPUMMR-RTRLPJTCSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as n-acyl-alpha-hexosamines. These are carbohydrate derivatives containing a hexose moiety in which the oxygen atom is replaced by an n-acyl group.

Kingdom

Organic compounds

Super Class

Organic oxygen compounds

Class

Organooxygen compounds

Sub Class

Carbohydrates and carbohydrate conjugates

Direct Parent

N-acyl-alpha-hexosamines

Alternative Parents

Substituents

N-acyl-alpha-hexosamine
Hexose monosaccharide
Monosaccharide phosphate
Monoalkyl phosphate
Monosaccharide
Organic phosphoric acid derivative
Oxane
Phosphoric acid ester
Alkyl phosphate
Acetamide
Secondary carboxylic acid amide
Secondary alcohol
Carboxamide group
Carboxylic acid derivative
Organoheterocyclic compound
Oxacycle
Primary alcohol
Carbonyl group
Organonitrogen compound
Organic oxide
Alcohol
Organopnictogen compound
Organic nitrogen compound
Hydrocarbon derivative
Aliphatic heteromonocyclic compound

Molecular Framework

Aliphatic heteromonocyclic compounds

External Descriptors

N-acetyl-D-glucosamine 1-phosphate (CHEBI:7125 )

Functional Ontology

Not Available

Physical Properties

State

Expected Solid

Predicted Properties

Property	Value	Source
Water Solubility	18.4 g/L	ALOGPS
logP	-2	ALOGPS
logP	-3.3	ChemAxon
logS	-1.2	ALOGPS
pKa (Strongest Acidic)	1.18	ChemAxon
pKa (Strongest Basic)	-0.79	ChemAxon
Physiological Charge	-2	ChemAxon
Hydrogen Acceptor Count	8	ChemAxon
Hydrogen Donor Count	6	ChemAxon
Polar Surface Area	165.78 Å²	ChemAxon
Rotatable Bond Count	4	ChemAxon
Refractivity	57.9 m³·mol⁻¹	ChemAxon
Polarizability	25.41 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

Spectra

Spectrum Type	Description	Splash Key	Deposition Date	View
Predicted GC-MS	Predicted GC-MS Spectrum - GC-MS (Non-derivatized) - 70eV, Positive	splash10-007k-9230000000-37cdd3ef185356d03c19	2016-09-22	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - GC-MS (3 TMS) - 70eV, Positive	splash10-0f6t-9211240000-817e06893a2ccced098b	2017-10-06	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - GC-MS (Non-derivatized) - 70eV, Positive	Not Available	2021-10-12	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 10V, Positive	splash10-0udi-1094000000-f1e04aaf05d431b8b0ab	2016-09-12	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 20V, Positive	splash10-0f7k-6290000000-6ff96a8c8bf54d5e8bfa	2016-09-12	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 40V, Positive	splash10-0f6t-9620000000-3e2ee2ffc3801abdb7da	2016-09-12	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 10V, Negative	splash10-002s-9211000000-7f3631860a58ca188060	2016-09-12	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 20V, Negative	splash10-004i-9110000000-9614f2b717f8fb17cc08	2016-09-12	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 40V, Negative	splash10-004i-9000000000-1a4f6aa02a49053d5b95	2016-09-12	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 10V, Positive	splash10-0udi-0269000000-3075b429edd6182c13ba	2021-09-23	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 20V, Positive	splash10-0udi-0559000000-4ca1cd5a6e65977c0024	2021-09-23	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 40V, Positive	splash10-0fk9-6900000000-1cb673f71135d27b87a1	2021-09-23	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 10V, Negative	splash10-0udi-1019000000-7dfe9f6a1a82e9cc6643	2021-09-24	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 20V, Negative	splash10-004i-9021000000-405c928cec60fc405bdb	2021-09-24	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 40V, Negative	splash10-004j-9000000000-5c37c1fa0342ac32c556	2021-09-24	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 100 MHz, D₂O, predicted)		2021-09-25	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 100 MHz, D₂O, predicted)		2021-09-25	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 1000 MHz, D₂O, predicted)		2021-09-25	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 1000 MHz, D₂O, predicted)		2021-09-25	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 200 MHz, D₂O, predicted)		2021-09-25	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 200 MHz, D₂O, predicted)		2021-09-25	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 300 MHz, D₂O, predicted)		2021-09-25	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 300 MHz, D₂O, predicted)		2021-09-25	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 400 MHz, D₂O, predicted)		2021-09-25	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 400 MHz, D₂O, predicted)		2021-09-25	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 500 MHz, D₂O, predicted)		2021-09-25	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 500 MHz, D₂O, predicted)		2021-09-25	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 600 MHz, D₂O, predicted)		2021-09-25	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 600 MHz, D₂O, predicted)		2021-09-25	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 700 MHz, D₂O, predicted)		2021-09-25	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 700 MHz, D₂O, predicted)		2021-09-25	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 800 MHz, D₂O, predicted)		2021-09-25	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 800 MHz, D₂O, predicted)		2021-09-25	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 900 MHz, D₂O, predicted)		2021-09-25	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 900 MHz, D₂O, predicted)		2021-09-25	View Spectrum

Chromatographic Retention Times and Retention Indices

Retention Times

Chromatography Type	Technique	Column	Deposition Date	Retention Time (s)
Liquid Chromatography	HILIC	Waters Acquity UPLC-BEH Amide column (eluted)	2025-10-23	527.6
Liquid Chromatography	HILIC	Accucore 150 Amide HILIC (eluted)	2025-10-23	413.7
Liquid Chromatography	Reversed-phase	Hypersil Gold 1.9 µm C18 (void)	2025-10-23	49.4
Liquid Chromatography	Reversed-phase	Agilent Zorbax Eclipse Plus C18 (2.1 mm x 150 mm, 3.5 um) (eluted)	2025-10-23	248.4
Liquid Chromatography	Reversed-phase	XBridge C18 3.5u 2.1x50 mm (eluted)	2025-10-23	308.5
Liquid Chromatography	Reversed-phase	Ascentis Express C18 (eluted)	2025-10-23	257.9
Liquid Chromatography	Reversed-phase	Waters ACQUITY UPLC HSS T3 C18 (void)	2025-10-23	430.5
Liquid Chromatography	HILIC	Merck SeQuant ZIC-HILIC (eluted)	2025-10-23	857.0
Liquid Chromatography	HILIC	Merck SeQuant ZIC-pHILIC (eluted)	2025-10-23	695.3
Liquid Chromatography	Reversed-phase	Waters ACQUITY UPLC HSS T3 C18 (eluted)	2025-10-23	151.9
Liquid Chromatography	HILIC	Merck SeQuant ZIC-HILIC (eluted)	2025-10-23	473.3
Liquid Chromatography	Reversed-phase	Waters ACQUITY UPLC HSS T3 C18 (eluted)	2025-10-23	168.5
Liquid Chromatography	Reversed-phase	Waters ACQUITY UPLC BEH C18 (eluted)	2025-10-23	33.6
Liquid Chromatography	HILIC	Merck SeQuant ZIC-pHILIC column (eluted)	2025-10-23	457.3
Liquid Chromatography	HILIC	Merck SeQuant ZIC-pHILIC column (eluted)	2025-10-23	785.3
Liquid Chromatography	Reversed-phase	Waters ACQUITY UPLC BEH C18 (void)	2025-10-23	72.5
Liquid Chromatography	Reversed-phase	Waters ACQUITY UPLC BEH C18 (void)	2025-10-23	291.7
Liquid Chromatography	Reversed-phase	Kinetex Core-Shell C18 2.6 um, 3.0 x 100 mm, Phenomenex (eluted)	2025-10-23	652.7
Liquid Chromatography	Reversed-phase	Waters Atlantis T3 (2.1 x 150 mm, 5 um) (eluted)	2025-10-23	543.5

Retention Indices

Chromatography Type	Peak Label	SMILES	Stationary Phase	Deposition Date	Retention Index
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_1	CC(=O)N[C@H]1C(OP(=O)(O)O)O[C@H](CO)[C@@H](O)[C@@H]1O[Si](C)(C)C	standard non polar	2025-10-23	2433.03
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_2	CC(=O)N[C@H]1C(OP(=O)(O)O)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O	standard non polar	2025-10-23	1690.54
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_3	CC(=O)N[C@H]1C(OP(=O)(O)O)O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@@H]1O	standard non polar	2025-10-23	1168.07
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_4	CC(=O)N[C@H]1C(OP(=O)(O)O[Si](C)(C)C)O[C@H](CO)[C@@H](O)[C@@H]1O	standard non polar	2025-10-23	1890.56
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_5	CC(=O)N([C@H]1C(OP(=O)(O)O)O[C@H](CO)[C@@H](O)[C@@H]1O)[Si](C)(C)C	standard non polar	2025-10-23	1650.87
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_6	CC(=O)N[C@H]1C(OP(=O)(O)O)O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	standard non polar	2025-10-23	2278.02
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_7	CC(=O)N[C@H]1C(OP(=O)(O)O)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	standard non polar	2025-10-23	1906.17
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_8	CC(=O)N[C@H]1C(OP(=O)(O)O[Si](C)(C)C)O[C@H](CO)[C@@H](O)[C@@H]1O[Si](C)(C)C	standard non polar	2025-10-23	2656.35
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_9	CC(=O)N([C@H]1C(OP(=O)(O)O)O[C@H](CO)[C@@H](O)[C@@H]1O[Si](C)(C)C)[Si](C)(C)C	standard non polar	2025-10-23	1784.32
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_10	CC(=O)N[C@H]1C(OP(=O)(O)O)O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	standard non polar	2025-10-23	1692.07
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_11	CC(=O)N[C@H]1C(OP(=O)(O)O[Si](C)(C)C)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O	standard non polar	2025-10-23	1540.34
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_12	CC(=O)N([C@H]1C(OP(=O)(O)O)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O)[Si](C)(C)C	standard non polar	2025-10-23	1381.39
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_13	CC(=O)N[C@H]1C(OP(=O)(O)O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@@H]1O	standard non polar	2025-10-23	1722.95
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_14	CC(=O)N([C@H]1C(OP(=O)(O)O)O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@@H]1O)[Si](C)(C)C	standard non polar	2025-10-23	1827.94
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_15	CC(=O)N[C@H]1C(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](CO)[C@@H](O)[C@@H]1O	standard non polar	2025-10-23	1765.86
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_16	CC(=O)N([C@H]1C(OP(=O)(O)O[Si](C)(C)C)O[C@H](CO)[C@@H](O)[C@@H]1O)[Si](C)(C)C	standard non polar	2025-10-23	1139.64
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_17	CC(=O)N[C@H]1C(OP(=O)(O)O)O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	standard non polar	2025-10-23	1812.36
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_18	CC(=O)N[C@H]1C(OP(=O)(O)O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	standard non polar	2025-10-23	1493.02
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_19	CC(=O)N([C@H]1C(OP(=O)(O)O)O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C)[Si](C)(C)C	standard non polar	2025-10-23	2010.29
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_20	CC(=O)N[C@H]1C(OP(=O)(O)O[Si](C)(C)C)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	standard non polar	2025-10-23	1870.26
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_21	CC(=O)N([C@H]1C(OP(=O)(O)O)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C)[Si](C)(C)C	standard non polar	2025-10-23	2843.03
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_22	CC(=O)N[C@H]1C(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](CO)[C@@H](O)[C@@H]1O[Si](C)(C)C	standard non polar	2025-10-23	1784.47
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_23	CC(=O)N([C@H]1C(OP(=O)(O)O[Si](C)(C)C)O[C@H](CO)[C@@H](O)[C@@H]1O[Si](C)(C)C)[Si](C)(C)C	standard non polar	2025-10-23	2494.52
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_24	CC(=O)N[C@H]1C(OP(=O)(O)O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	standard non polar	2025-10-23	2186.73
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_25	CC(=O)N([C@H]1C(OP(=O)(O)O)O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O)[Si](C)(C)C	standard non polar	2025-10-23	2054.5
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_26	CC(=O)N[C@H]1C(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O	standard non polar	2025-10-23	1880.86
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_27	CC(=O)N([C@H]1C(OP(=O)(O)O[Si](C)(C)C)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O)[Si](C)(C)C	standard non polar	2025-10-23	1176.5
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_28	CC(=O)N[C@H]1C(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@@H]1O	standard non polar	2025-10-23	2689.26
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_29	CC(=O)N([C@H]1C(OP(=O)(O)O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@@H]1O)[Si](C)(C)C	standard non polar	2025-10-23	2252.99
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_30	CC(=O)N([C@H]1C(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](CO)[C@@H](O)[C@@H]1O)[Si](C)(C)C	standard non polar	2025-10-23	2943.42
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_31	CC(=O)N[C@H]1C(OP(=O)(O)O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	standard non polar	2025-10-23	2043.42
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_32	CC(=O)N([C@H]1C(OP(=O)(O)O)O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C)[Si](C)(C)C	standard non polar	2025-10-23	2066.71
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_33	CC(=O)N[C@H]1C(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	standard non polar	2025-10-23	1900.49
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_34	CC(=O)N([C@H]1C(OP(=O)(O)O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C)[Si](C)(C)C	standard non polar	2025-10-23	2307.65
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_35	CC(=O)N[C@H]1C(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	standard non polar	2025-10-23	2974.87
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_36	CC(=O)N([C@H]1C(OP(=O)(O)O[Si](C)(C)C)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C)[Si](C)(C)C	standard non polar	2025-10-23	1291.84
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_37	CC(=O)N([C@H]1C(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](CO)[C@@H](O)[C@@H]1O[Si](C)(C)C)[Si](C)(C)C	standard non polar	2025-10-23	2098.48
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_38	CC(=O)N[C@H]1C(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	standard non polar	2025-10-23	1439.79
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_39	CC(=O)N([C@H]1C(OP(=O)(O)O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O)[Si](C)(C)C	standard non polar	2025-10-23	1985.31
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_40	CC(=O)N([C@H]1C(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O)[Si](C)(C)C	standard non polar	2025-10-23	2566.8
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_41	CC(=O)N([C@H]1C(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@@H]1O)[Si](C)(C)C	standard non polar	2025-10-23	1855.14
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_42	CC(=O)N[C@H]1C(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	standard non polar	2025-10-23	1275.6
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_43	CC(=O)N([C@H]1C(OP(=O)(O)O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C)[Si](C)(C)C	standard non polar	2025-10-23	2038.09
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_44	CC(=O)N([C@H]1C(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C)[Si](C)(C)C	standard non polar	2025-10-23	2552.63
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_45	CC(=O)N([C@H]1C(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C)[Si](C)(C)C	standard non polar	2025-10-23	1924.58
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_46	CC(=O)N([C@H]1C(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O)[Si](C)(C)C	standard non polar	2025-10-23	1791.99
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_47	CC(=O)N([C@H]1C(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C)[Si](C)(C)C	standard non polar	2025-10-23	1211.9
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_1	CC(=O)N[C@H]1C(OP(=O)(O)O)O[C@H](CO)[C@@H](O)[C@@H]1O[Si](C)(C)C	standard polar	2025-10-23	2205.27
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_2	CC(=O)N[C@H]1C(OP(=O)(O)O)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O	standard polar	2025-10-23	1794.72
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_3	CC(=O)N[C@H]1C(OP(=O)(O)O)O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@@H]1O	standard polar	2025-10-23	2184.85
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_4	CC(=O)N[C@H]1C(OP(=O)(O)O[Si](C)(C)C)O[C@H](CO)[C@@H](O)[C@@H]1O	standard polar	2025-10-23	2386.5
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_5	CC(=O)N([C@H]1C(OP(=O)(O)O)O[C@H](CO)[C@@H](O)[C@@H]1O)[Si](C)(C)C	standard polar	2025-10-23	1979.68
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_6	CC(=O)N[C@H]1C(OP(=O)(O)O)O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	standard polar	2025-10-23	2590.15
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_7	CC(=O)N[C@H]1C(OP(=O)(O)O)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	standard polar	2025-10-23	1867.13
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_8	CC(=O)N[C@H]1C(OP(=O)(O)O[Si](C)(C)C)O[C@H](CO)[C@@H](O)[C@@H]1O[Si](C)(C)C	standard polar	2025-10-23	1827.4
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_9	CC(=O)N([C@H]1C(OP(=O)(O)O)O[C@H](CO)[C@@H](O)[C@@H]1O[Si](C)(C)C)[Si](C)(C)C	standard polar	2025-10-23	2023.92
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_10	CC(=O)N[C@H]1C(OP(=O)(O)O)O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	standard polar	2025-10-23	1816.04
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_11	CC(=O)N[C@H]1C(OP(=O)(O)O[Si](C)(C)C)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O	standard polar	2025-10-23	2317.26
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_12	CC(=O)N([C@H]1C(OP(=O)(O)O)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O)[Si](C)(C)C	standard polar	2025-10-23	2612.4
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_13	CC(=O)N[C@H]1C(OP(=O)(O)O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@@H]1O	standard polar	2025-10-23	2498.75
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_14	CC(=O)N([C@H]1C(OP(=O)(O)O)O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@@H]1O)[Si](C)(C)C	standard polar	2025-10-23	2369.41
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_15	CC(=O)N[C@H]1C(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](CO)[C@@H](O)[C@@H]1O	standard polar	2025-10-23	1842.73
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_16	CC(=O)N([C@H]1C(OP(=O)(O)O[Si](C)(C)C)O[C@H](CO)[C@@H](O)[C@@H]1O)[Si](C)(C)C	standard polar	2025-10-23	1715.78
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_17	CC(=O)N[C@H]1C(OP(=O)(O)O)O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	standard polar	2025-10-23	1645.41
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_18	CC(=O)N[C@H]1C(OP(=O)(O)O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	standard polar	2025-10-23	1384.39
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_19	CC(=O)N([C@H]1C(OP(=O)(O)O)O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C)[Si](C)(C)C	standard polar	2025-10-23	1956.11
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_20	CC(=O)N[C@H]1C(OP(=O)(O)O[Si](C)(C)C)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	standard polar	2025-10-23	2086.93
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_21	CC(=O)N([C@H]1C(OP(=O)(O)O)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C)[Si](C)(C)C	standard polar	2025-10-23	1515.03
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_22	CC(=O)N[C@H]1C(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](CO)[C@@H](O)[C@@H]1O[Si](C)(C)C	standard polar	2025-10-23	2531.45
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_23	CC(=O)N([C@H]1C(OP(=O)(O)O[Si](C)(C)C)O[C@H](CO)[C@@H](O)[C@@H]1O[Si](C)(C)C)[Si](C)(C)C	standard polar	2025-10-23	2473.36
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_24	CC(=O)N[C@H]1C(OP(=O)(O)O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	standard polar	2025-10-23	1819.87
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_25	CC(=O)N([C@H]1C(OP(=O)(O)O)O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O)[Si](C)(C)C	standard polar	2025-10-23	1745.54
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_26	CC(=O)N[C@H]1C(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O	standard polar	2025-10-23	2300.41
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_27	CC(=O)N([C@H]1C(OP(=O)(O)O[Si](C)(C)C)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O)[Si](C)(C)C	standard polar	2025-10-23	1502.01
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_28	CC(=O)N[C@H]1C(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@@H]1O	standard polar	2025-10-23	2182.65
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_29	CC(=O)N([C@H]1C(OP(=O)(O)O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@@H]1O)[Si](C)(C)C	standard polar	2025-10-23	2637.24
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_30	CC(=O)N([C@H]1C(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](CO)[C@@H](O)[C@@H]1O)[Si](C)(C)C	standard polar	2025-10-23	2378.54
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_31	CC(=O)N[C@H]1C(OP(=O)(O)O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	standard polar	2025-10-23	2543.74
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_32	CC(=O)N([C@H]1C(OP(=O)(O)O)O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C)[Si](C)(C)C	standard polar	2025-10-23	1102.07
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_33	CC(=O)N[C@H]1C(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	standard polar	2025-10-23	1497.68
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_34	CC(=O)N([C@H]1C(OP(=O)(O)O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C)[Si](C)(C)C	standard polar	2025-10-23	2724.8
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_35	CC(=O)N[C@H]1C(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	standard polar	2025-10-23	2936.14
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_36	CC(=O)N([C@H]1C(OP(=O)(O)O[Si](C)(C)C)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C)[Si](C)(C)C	standard polar	2025-10-23	1619.79
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_37	CC(=O)N([C@H]1C(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](CO)[C@@H](O)[C@@H]1O[Si](C)(C)C)[Si](C)(C)C	standard polar	2025-10-23	1961.69
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_38	CC(=O)N[C@H]1C(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	standard polar	2025-10-23	2465.84
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_39	CC(=O)N([C@H]1C(OP(=O)(O)O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O)[Si](C)(C)C	standard polar	2025-10-23	1661.36
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_40	CC(=O)N([C@H]1C(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O)[Si](C)(C)C	standard polar	2025-10-23	1252.53
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_41	CC(=O)N([C@H]1C(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@@H]1O)[Si](C)(C)C	standard polar	2025-10-23	2070.29
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_42	CC(=O)N[C@H]1C(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	standard polar	2025-10-23	1560.78
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_43	CC(=O)N([C@H]1C(OP(=O)(O)O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C)[Si](C)(C)C	standard polar	2025-10-23	1990.97
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_44	CC(=O)N([C@H]1C(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C)[Si](C)(C)C	standard polar	2025-10-23	1554.33
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_45	CC(=O)N([C@H]1C(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C)[Si](C)(C)C	standard polar	2025-10-23	4472.64
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_46	CC(=O)N([C@H]1C(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O)[Si](C)(C)C	standard polar	2025-10-23	2090.56
Gas Chromatography	N-Acetyl-glucosamine 1-phosphate_TMS_47	CC(=O)N([C@H]1C(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C)[Si](C)(C)C	standard polar	2025-10-23	1877.47

Biological Properties

Cellular Locations

Cytoplasm

Biospecimen Locations

Feces
Placenta
Saliva

Tissue Locations

Placenta

Associated OMIM IDs

114500 (Colorectal cancer)
610247 (Eosinophilic esophagitis)

Human Proteins and Enzymes

Protein ID	Protein Name	Protein Type	Uniprot ID	Species
MMDBp0192685	UDP-N-acetylhexosamine pyrophosphorylase	Enzyme	Q16222	Homo sapiens
MMDBp0193141	Phosphoacetylglucosamine mutase	Unknown	O95394	Homo sapiens
MMDBp0197002	UDP-N-acetylhexosamine pyrophosphorylase-like protein 1	Unknown	Q3KQV9

Human Pathways

Pathways

Name	SMPDB/PathBank

Microbial Pathways

Pathways

This table shows at most 5 pathways. For the full list of associated pathways:

See All Associated Bacterial Pathways

Name	SMPDB/PathBank	Species
1,6-Anhydro-N-acetylmuramic Acid Recycling		Escherichia coli Pseudomonas aeruginosa Escherichia coli SMS-3-5 Escherichia coli UTI89 Escherichia coli 55989 Escherichia coli SE11 Pseudomonas aeruginosa PA7 Actinobacillus succinogenes 130Z Escherichia coli CFT073 Ochrobactrum anthropi Klebsiella pneumoniae Bacillus cereus Pseudomonas fluorescens Pf-5 Streptomyces griseus subsp. griseus NBRC 13350 Salmonella enterica Haemophilus influenzae Haemophilus influenzae Rd KW20 Saccharopolyspora erythraea NRRL 2338 Streptomyces avermitilis MA-4680 Shewanella denitrificans OS217 Bacillus timonensis 10403023 Clostridium saccharolyticum Haemophilus parainfluenzae T3T1 Methylobacterium nodulans Ochrobactrum anthropi ATCC 49188 Ochrobactrum intermedium LMG 3301 Burkholderia cepacia Pseudomonas fluorescens Xanthomonas campestris Bradyrhizobium japonicum Mesorhizobium loti Sinorhizobium meliloti Acidiphilium cryptum Chromobacterium violaceum Citrobacter koseri Proteus mirabilis Shigella boydii Shigella dysenteriae Shigella flexneri Shigella sonnei Aeromonas hydrophila Vibrio vulnificus Enterococcus gallinarum Bacillus pumilus Clostridium butyricum Xylella fastidiosa Roseobacter denitrificans Enterococcus casseliflavus Stenotrophomonas maltophilia Actinosynnema mirum Burkholderia vietnamiensis Sodalis glossinidius Enterobacter cancerogenus Bacillus selenitireducens Burkholderia multivorans Burkholderia cenocepacia Methylibium petroleiphilum Citrobacter youngae Collinsella stercoris Burkholderia ambifaria Shewanella denitrificans Escherichia albertii Agrobacterium tumefaciens Haemophilus parainfluenzae Klebsiella variicola Granulicatella adiacens Actinobacillus pleuropneumoniae serovar 5b str. L20 Actinobacillus pleuropneumoniae serovar 3 str. JL03 Actinobacillus pleuropneumoniae serovar 7 str. AP76 Aeromonas hydrophila subsp. hydrophila ATCC 7966 Agrobacterium tumefaciens str. C58 Citrobacter koseri ATCC BAA-895 Cronobacter sakazakii ATCC BAA-894 Dyadobacter fermentans DSM 18053 Enterobacter cloacae subsp. cloacae ATCC 13047 Escherichia coli APEC O1 Escherichia coli E24377A Escherichia coli O127:H6 str. E2348/69 Escherichia coli UMN026 Escherichia fergusonii ATCC 35469 Escherichia coli ED1a Escherichia coli IAI39 Klebsiella pneumoniae subsp. pneumoniae MGH 78578 Mesorhizobium loti MAFF303099 Methylobacterium populi BJ001 Escherichia coli 042 Edwardsiella tarda FL6-60 Proteus mirabilis HI4320 Pseudomonas fluorescens Pf0-1 Pseudomonas fluorescens SBW25 Rhizobium leguminosarum bv. viciae 3841 Rhizobium leguminosarum bv. trifolii WSM2304 Rhodococcus erythropolis PR4 Salmonella enterica subsp. enterica serovar Typhimurium str. LT2 Salmonella enterica subsp. enterica serovar Newport str. SL254 Salmonella enterica subsp. enterica serovar Heidelberg str. SL476 Salmonella enterica subsp. enterica serovar Agona str. SL483 Salmonella enterica subsp. enterica serovar Dublin str. CT02021853 Shigella sonnei Ss046 Shigella dysenteriae Sd197 Shigella flexneri 5 str. 8401 Spirosoma linguale DSM 74 Stenotrophomonas maltophilia K279a Stenotrophomonas maltophilia R551-3 Vibrio parahaemolyticus RIMD 2210633 Yersinia enterocolitica subsp. enterocolitica 8081 Yersinia pseudotuberculosis IP 31758 Spirosoma linguale Rhizobium etli Burkholderia cepacia GG4 Cedecea davisae Cedecea davisae DSM 4568 Citrobacter amalonaticus Citrobacter amalonaticus Y19 Citrobacter freundii Citrobacter youngae ATCC 29220 Enterobacter hormaechei Escherichia albertii TW07627 Klebsiella aerogenes Salmonella Salmonella enterica subsp. enterica serovar Typhimurium Trabulsiella guamensis Trabulsiella guamensis ATCC 49490 Tatumella ptyseos Tatumella ptyseos ATCC 33301 Edwardsiella tarda Edwardsiella tarda ATCC 23685 Hafnia alvei Hafnia alvei ATCC 51873 Morganella morganii Morganella morganii subsp. morganii KT Providencia rustigianii DSM 4541 Providencia stuartii ATCC 25827 Serratia marcescens subsp. marcescens Db11 Yersinia enterocolitica Yersinia pestis Yersinia pseudotuberculosis Plesiomonas shigelloides 302-73 Actinobacillus pleuropneumoniae Aggregatibacter aphrophilus Haemophilus haemolyticus Haemophilus sputorum Francisella tularensis Grimontia hollisae CIP 101886 Vibrio fluvialis Vibrio fluvialis PG41 Vibrio parahaemolyticus Vibrio mimicus Rhodococcus erythropolis Brevibacterium casei Brevibacterium casei S18 Brevibacterium linens Streptomyces avermitilis Olsenella profusa F0195 Collinsella stercoris DSM 13279 Paenibacillus lactis 154 Granulicatella adiacens ATCC 49175 Enterococcus caccae ATCC BAA-1240 Enterococcus casseliflavus ATCC 12755 Clostridium butyricum E4 str. BoNT E BL5262 Clostridium celatum DSM 1785 Streptomyces coelicolor A3(2) Ralstonia eutropha H16 Xanthomonas campestris pv. campestris str. ATCC 33913 Xanthomonas campestris pv. campestris str. B100 Xanthomonas campestris pv. campestris str. 8004 Vibrio cholerae M66-2 Vibrio cholerae O1 biovar El Tor str. N16961 Lachnoclostridium phytofermentans ISDg Alkaliphilus metalliredigens QYMF Amycolatopsis mediterranei U32 Bacillus selenitireducens MLS10 Beutenbergia cavernae DSM 12333 Catenulispora acidiphila DSM 44928 Deinococcus geothermalis DSM 11300 Kribbella flavida DSM 17836 Meiothermus ruber DSM 1279 Oceanobacillus iheyensis HTE831 Thermobaculum terrenum ATCC BAA-798 Rubrobacter xylanophilus DSM 9941 Saccharomonospora viridis DSM 43017 Stackebrandtia nassauensis DSM 44728 Streptomyces scabiei 87.22 Streptomyces violaceusniger Tu 4113 Streptosporangium roseum DSM 43021 Symbiobacterium thermophilum IAM 14863 Aspergillus nomiae NRRL 13137 Aspergillus novofumigatus Aspergillus novofumigatus IBT 16806 Aspergillus niger ATCC 1015 Aspergillus oryzae RIB40 Aspergillus terreus NIH2624 Aspergillus fischeri NRRL 181 Aspergillus fumigatus A1163 Aspergillus fumigatus Af293 Aspergillus calidoustus Aspergillus nidulans FGSC A4 Aspergillus tamarii Aspergillus thermomutatus Aspergillus viridinutans Penicillium brasilianum Penicillium brevicompactum Penicillium citrinum Penicillium concentricum Penicillium daleae Penicillium griseofulvum Penicillium hordei Penicillium nalgiovense Penicillium polonicum Penicillium roqueforti FM164 Penicillium solitum Penicillium steckii Penicillium thymicola Verticillium alfalfae VaMs.102 Fusarium vanettenii Fusarium vanettenii 77-13-4 Klebsiella aerogenes KCTC 2190 Acaryochloris marina MBIC11017 Acidiphilium cryptum JF-5 Acidiphilium multivorum AIU301 Acidobacterium capsulatum ATCC 51196 Agrobacterium vitis S4 Agrobacterium radiobacter K84 Vibrio fischeri MJ11 Aliivibrio salmonicida LFI1238 Anabaena variabilis ATCC 29413 Mannheimia succiniciproducens MBEL55E Brachyspira hyodysenteriae WA1 Brucella melitensis bv. 1 str. 16M Brucella abortus bv. 1 str. 9-941 Brucella ovis ATCC 25840 Brucella canis ATCC 23365 Brucella suis ATCC 23445 Brucella abortus S19 Brucella melitensis ATCC 23457 Burkholderia mallei ATCC 23344 Burkholderia pseudomallei 1710b Burkholderia sp. 383 Burkholderia xenovorans LB400 Burkholderia ambifaria AMMD Burkholderia mallei NCTC 10229 Burkholderia pseudomallei 1106a Burkholderia vietnamiensis G4 Burkholderia cenocepacia MC0-3 Burkholderia ambifaria MC40-6 Burkholderia phymatum STM815 Burkholderia phytofirmans PsJN Burkholderia cenocepacia J2315 Burkholderia rhizoxinica HKI 454 Candidatus Koribacter versatilis Ellin345 Caulobacter crescentus CB15 Caulobacter crescentus NA1000 Caulobacter segnis ATCC 21756 Cellvibrio japonicus Ueda107 Chitinophaga pinensis DSM 2588 Citrobacter rodentium ICC168 Colwellia psychrerythraea 34H Cronobacter turicensis z3032 Cupriavidus necator N-1 Cyanothece sp. ATCC 51142 Cyanothece sp. PCC 8801 Cyanothece sp. PCC 7424 Deinococcus deserti VCD115 Dichelobacter nodosus VCS1703A Dickeya dadantii Ech703 Dickeya zeae Ech1591 Dickeya dadantii Ech586 Dickeya dadantii 3937 Edwardsiella ictaluri 93-146 Enterobacter sp. 638 Enterobacter cloacae SCF1 Erwinia tasmaniensis Et1/99 Erwinia amylovora CFBP1430 Erwinia billingiae Eb661 Ferrimonas balearica DSM 9799 Francisella tularensis subsp. holarctica LVS Gloeobacter violaceus PCC 7421 Haemophilus parasuis SH0165 Hahella chejuensis KCTC 2396 Haliangium ochraceum DSM 14365 Jannaschia sp. CCS1 Klebsiella pneumoniae 342 Kosmotoga olearia TBF 19.5.1 Leadbetterella byssophila DSM 17132 Leptothrix cholodnii SP-6 Meiothermus silvanus DSM 9946 Methylibium petroleiphilum PM1 Methylobacterium chloromethanicum CM4 Methylobacterium nodulans ORS 2060 Methylobacterium extorquens AM1 Methylobacterium extorquens DM4 Microcystis aeruginosa NIES-843 Nostoc sp. PCC 7120 Nostoc punctiforme PCC 73102 Xanthomonas axonopodis pv. citri str. 306 Chromobacterium violaceum ATCC 12472 Sodalis glossinidius str. 'morsitans' Elusimicrobium minutum Pei191 Alteromonas macleodii str. 'Deep ecotype' Thermus scotoductus SA-01 Rhodobacter capsulatus SB1003 Pantoea ananatis LMG 20103 Paracoccus denitrificans PD1222 Pasteurella multocida subsp. multocida str. Pm70 Pectobacterium atrosepticum SCRI1043 Pectobacterium carotovorum subsp. carotovorum PC1 Pedobacter heparinus DSM 2366 Petrotoga mobilis SJ95 Photobacterium profundum SS9 Photorhabdus luminescens subsp. laumondii TTO1 Photorhabdus asymbiotica subsp. asymbiotica ATCC 43949 Prochlorococcus marinus subsp. marinus str. CCMP1375 Prochlorococcus marinus str. MIT 9313 Prochlorococcus marinus str. NATL2A Prochlorococcus marinus str. NATL1A Prochlorococcus marinus str. MIT 9303 Prochlorococcus marinus str. MIT 9211 Pseudoalteromonas haloplanktis TAC125 Pseudomonas entomophila L48 Psychromonas ingrahamii 37 Rhizobium etli CFN 42 Rhizobium etli CIAT 652 Rhizobium leguminosarum bv. trifolii WSM1325 Rhodospirillum centenum SW Roseobacter denitrificans OCh 114 Roseobacter litoralis Och 149 Ruegeria pomeroyi DSS-3 Ruegeria sp. TM1040 Saccharophagus degradans 2-40 Salinibacter ruber DSM 13855 Salmonella enterica subsp. enterica serovar Paratyphi A str. Shewanella oneidensis MR-1 Shewanella sp. ANA-3 Shewanella amazonensis SB2B Shewanella sp. W3-18-1 Shewanella baltica OS155 Shewanella loihica PV-4 Shewanella sediminis HAW-EB3 Shewanella pealeana ATCC 700345 Shewanella baltica OS195 Shewanella halifaxensis HAW-EB4 Shewanella woodyi ATCC 51908 Shewanella piezotolerans WP3 Shewanella violacea DSS12 Shigella flexneri 2a str. 301 Shigella boydii Sb227 Shigella boydii CDC 3083-94 Sinorhizobium meliloti 1021 Sinorhizobium medicae WSM419 Sphingomonas wittichii RW1 Synechococcus sp. WH 8102 Synechococcus sp. CC9902 Synechococcus sp. CC9311 Synechococcus sp. WH 7803 Synechococcus sp. RCC307 Synechococcus sp. PCC 7002 Teredinibacter turnerae T7901 Tolumonas auensis DSM 9187 Verminephrobacter eiseniae EF01-2 Vibrio vulnificus CMCP6 Vibrio vulnificus YJ016 Vibrio splendidus LGP32 Xanthomonas oryzae pv. oryzae KACC10331 Xanthomonas campestris pv. vesicatoria str. 85-10 Xanthomonas oryzae pv. oryzae PXO99A Xenorhabdus bovienii SS-2004 Xenorhabdus nematophila ATCC 19061 Xylella fastidiosa 9a5c Xylella fastidiosa Temecula1 Xylella fastidiosa M23 Zunongwangia profunda SM-A87 Zymomonas mobilis subsp. pomaceae ATCC 29192 Sphingobacterium paucimobilis HER1398 Atlantibacter hermannii NBRC 105704 Klebsiella michiganensis KCTC 1686 Chania multitudinisentens RB-25
Amino Sugar and Nucleotide Sugar Metabolism I		Escherichia coli Escherichia coli UTI89 Escherichia coli CFT073 Bacillus cereus Streptomyces griseus subsp. griseus NBRC 13350 Enterococcus hirae ATCC 9790 Escherichia coli APEC O1 Escherichia coli ED1a Yersinia enterocolitica subsp. enterocolitica 8081 Trabulsiella guamensis Trabulsiella guamensis ATCC 49490 Providencia stuartii ATCC 25827 Clostridium sartagoforme AAU1 Catenulispora acidiphila DSM 44928 Citrobacter rodentium ICC168 Edwardsiella ictaluri 93-146 Photorhabdus luminescens subsp. laumondii TTO1 Photorhabdus asymbiotica subsp. asymbiotica ATCC 43949 Xenorhabdus bovienii SS-2004 Xenorhabdus nematophila ATCC 19061 Chania multitudinisentens RB-25
Lipopolysaccharide Biosynthesis		Escherichia coli UTI89 Escherichia coli 55989 Escherichia coli SE11 Klebsiella pneumoniae Salmonella enterica Citrobacter koseri Proteus mirabilis Shigella boydii Sodalis glossinidius Escherichia albertii Bacteroides fluxus Klebsiella variicola Actinobacillus pleuropneumoniae serovar 3 str. JL03 Citrobacter koseri ATCC BAA-895 Enterobacter cloacae subsp. cloacae ATCC 13047 Escherichia coli O127:H6 str. E2348/69 Escherichia coli ED1a Klebsiella pneumoniae subsp. pneumoniae MGH 78578 Pseudomonas fluorescens Pf0-1 Salmonella enterica subsp. enterica serovar Typhimurium str. LT2 Salmonella enterica subsp. enterica serovar Newport str. SL254 Salmonella enterica subsp. enterica serovar Heidelberg str. SL476 Salmonella enterica subsp. enterica serovar Agona str. SL483 Salmonella enterica subsp. enterica serovar Dublin str. CT02021853 Bacteroides fluxus YIT 12057 Laribacter hongkongensis Cedecea davisae Cedecea davisae DSM 4568 Citrobacter amalonaticus Citrobacter amalonaticus Y19 Escherichia albertii TW07627 Salmonella Salmonella enterica subsp. enterica serovar Typhimurium Tatumella ptyseos Tatumella ptyseos ATCC 33301 Hafnia alvei Hafnia alvei ATCC 51873 Providencia rustigianii DSM 4541 Serratia marcescens subsp. marcescens Db11 Klebsiella aerogenes KCTC 2190 Citrobacter rodentium ICC168 Cronobacter turicensis z3032 Erwinia tasmaniensis Et1/99 Erwinia amylovora CFBP1430 Methylobacillus flagellatus KT Sodalis glossinidius str. 'morsitans' Psychromonas ingrahamii 37 Salmonella enterica subsp. enterica serovar Paratyphi A str. Klebsiella michiganensis KCTC 1686
Lipopolysaccharide Biosynthesis (1-Octadecanoyl-rac-glycerol)		Escherichia coli SMS-3-5 Escherichia coli UTI89 Escherichia coli 55989 Escherichia coli SE11 Klebsiella pneumoniae Pseudomonas fluorescens Pf-5 Salmonella enterica Campylobacter fetus subsp. fetus 82-40 Campylobacter rectus Pseudomonas fluorescens Pseudomonas putida Citrobacter koseri Proteus mirabilis Shigella boydii Campylobacter upsaliensis Helicobacter pullorum Escherichia albertii Klebsiella variicola Actinobacillus pleuropneumoniae serovar 3 str. JL03 Citrobacter koseri ATCC BAA-895 Enterobacter cloacae subsp. cloacae ATCC 13047 Escherichia coli O127:H6 str. E2348/69 Escherichia coli ED1a Klebsiella pneumoniae subsp. pneumoniae MGH 78578 Pseudomonas putida KT2440 Pseudomonas fluorescens Pf0-1 Pseudomonas fluorescens SBW25 Salmonella enterica subsp. enterica serovar Typhimurium str. LT2 Salmonella enterica subsp. enterica serovar Newport str. SL254 Salmonella enterica subsp. enterica serovar Heidelberg str. SL476 Salmonella enterica subsp. enterica serovar Agona str. SL483 Salmonella enterica subsp. enterica serovar Dublin str. CT02021853 Stenotrophomonas maltophilia R551-3 Cetobacterium somerae ATCC BAA-474 Parasutterella excrementihominis YIT 11859 Campylobacter rectus RM3267 Campylobacter upsaliensis JV21 Helicobacter pullorum MIT 98-5489 Aeromonas veronii Cedecea davisae Cedecea davisae DSM 4568 Citrobacter amalonaticus Citrobacter amalonaticus Y19 Escherichia albertii TW07627 Salmonella Salmonella enterica subsp. enterica serovar Typhimurium Tatumella ptyseos Tatumella ptyseos ATCC 33301 Hafnia alvei Hafnia alvei ATCC 51873 Providencia rustigianii DSM 4541 Klebsiella aerogenes KCTC 2190 Azotobacter vinelandii DJ
Lipopolysaccharide Biosynthesis (1,2-Diacyl-sn-glycerol (dihexadec-9-enoyl, n-C16:1))		Escherichia coli SMS-3-5 Escherichia coli UTI89 Escherichia coli 55989 Escherichia coli SE11 Klebsiella pneumoniae Pseudomonas fluorescens Pf-5 Salmonella enterica Campylobacter fetus subsp. fetus 82-40 Campylobacter rectus Pseudomonas fluorescens Pseudomonas putida Citrobacter koseri Proteus mirabilis Shigella boydii Campylobacter upsaliensis Helicobacter pullorum Escherichia albertii Klebsiella variicola Actinobacillus pleuropneumoniae serovar 3 str. JL03 Citrobacter koseri ATCC BAA-895 Enterobacter cloacae subsp. cloacae ATCC 13047 Escherichia coli O127:H6 str. E2348/69 Escherichia coli ED1a Klebsiella pneumoniae subsp. pneumoniae MGH 78578 Pseudomonas putida KT2440 Pseudomonas fluorescens Pf0-1 Pseudomonas fluorescens SBW25 Salmonella enterica subsp. enterica serovar Typhimurium str. LT2 Salmonella enterica subsp. enterica serovar Newport str. SL254 Salmonella enterica subsp. enterica serovar Heidelberg str. SL476 Salmonella enterica subsp. enterica serovar Agona str. SL483 Salmonella enterica subsp. enterica serovar Dublin str. CT02021853 Stenotrophomonas maltophilia R551-3 Cetobacterium somerae ATCC BAA-474 Parasutterella excrementihominis YIT 11859 Campylobacter rectus RM3267 Campylobacter upsaliensis JV21 Helicobacter pullorum MIT 98-5489 Aeromonas veronii Cedecea davisae Cedecea davisae DSM 4568 Citrobacter amalonaticus Citrobacter amalonaticus Y19 Escherichia albertii TW07627 Salmonella Salmonella enterica subsp. enterica serovar Typhimurium Tatumella ptyseos Tatumella ptyseos ATCC 33301 Hafnia alvei Hafnia alvei ATCC 51873 Providencia rustigianii DSM 4541 Klebsiella aerogenes KCTC 2190 Azotobacter vinelandii DJ

Metabolic Reactions

Reactions

This table shows at most 20 reactions. For the full list of associated reactions:

See All Associated Reactions

Reaction ID	Precursor	Product	Enzyme	Reaction Type	Data Source	Reference
MMDBr0018442	Glucosamine-1P	N-Acetyl-glucosamine 1-phosphate	Bifunctional protein GlmU		PathBank	31602464
MMDBr0018443	Uridine triphosphate	Uridine diphosphate-N-acetylglucosamine	Bifunctional protein GlmU		PathBank	31602464
MMDBr0019557	N-Acetyl-D-Glucosamine 6-Phosphate	N-Acetyl-glucosamine 1-phosphate	Phosphoacetylglucosamine mutase		PathBank	31602464
MMDBr0019558	Uridine triphosphate	Uridine diphosphate-N-acetylglucosamine	UDP-N-acetylglucosamine pyrophosphorylase	Phosphorylation	PathBank	31602464

Health Effects and Bioactivity

Health Outcome/Bioactivity	Metabolite Response/Effect	Evidence Type	Host and Biospecimen	Data Source	Reference

Microbial Sources

Superkingdom/Kingdom	Phylum	Total species	Hosts and Body Sites	Microbial Links
Bacteria	Proteobacteria	1	Human feces; Human sputum; Human ; Human unknown; Pig ; Human pleural fluid plaque; Human dental plaque; Human nasal swab; Human feces; pleural fluid plaque; bal	Unknown; Metabolic reconstruction
Bacteria/Eubacteria	Firmicutes	389	Human feces; Human pleural fluid plaque; Pig ; Human sputum; Human ; Human subgingival plaque; Human saliva; Human urine; Human mucosa; Human supragingival plaque; Cattle	Metabolic reconstruction
Bacteria/Eubacteria	Proteobacteria	179	Human feces; Human sputum; Human ; Human unknown; Pig ; Human pleural fluid plaque; Human dental plaque; Human nasal swab; Human feces; pleural fluid plaque; bal	Unknown; Metabolic reconstruction
Bacteria/Eubacteria	Actinobacteria	128	Human feces; Human sputum; Human bronchial brush; Human nasopharyngeal swab; Human pleural fluid plaque; Human dental plaque; Human ; Human supragingival plaque; Human mucosa; Human subgingival plaque; Human saliva	Metabolic reconstruction
Bacteria/Eubacteria	Verrucomicrobia	1	Human ; Human feces	Metabolic reconstruction
Bacteria/Eubacteria	Bacteroidetes	123	Human feces; Human appendix biopsy; Human ; Human saliva; Human gastric fluid; Human urine; Human subgingival plaque; Human supragingival plaque	Metabolic reconstruction
Bacteria/Eubacteria	Synergistetes	3	Human feces	Metabolic reconstruction
Bacteria	Firmicutes	2	Human feces; Human pleural fluid plaque; Pig ; Human sputum; Human ; Human subgingival plaque; Human saliva; Human urine; Human mucosa; Human supragingival plaque; Cattle	Metabolic reconstruction
Bacteria/Eubacteria	Spirochaetes	1	Human feces	Metabolic reconstruction
Archaea	Thaumarchaeota	1		Metabolic reconstruction
Bacteria/Eubacteria	Fusobacteria	20	Human feces; Human	Metabolic reconstruction
Archaea	Euryarchaeota	5		Metabolic reconstruction
Bacteria/Eubacteria	Candidatus melainabacteria	1	Human feces	Metabolic reconstruction
Bacteria/Eubacteria	Planctomycetes	1	Human feces	Metabolic reconstruction
Archaea	Crenarchaeota	1		Metabolic reconstruction
Bacteria/Eubacteria	Tenericutes	2	Human feces	Metabolic reconstruction
Bacteria	Synergistetes	1	Human feces	Metabolic reconstruction
Eukaryota/Fungi	Ascomycota	1	Human feces; Human saliva	Unknown

Exposure Sources

Other Exposures

Source Type	Data Source	Reference

Host Biospecimen and Location

Host and Biospecimen	Status	Mean	Std	Units	Age	Sex	Health Condition	Data Source	Reference
Human Feces	Detected but not Quantified							HMDB
Human Saliva	Detected and Quantified	0.135	0.363	uM	Adult (>18 years old)	Male	Normal	HMDB	Sugimoto et al. (2013) Physiological and environmental parameters associated with mass spectrometry-based salivary metabolomic profiles.
Human Saliva	Detected and Quantified	0.251	0.167	uM	Adult (>18 years old)	Female	Normal	HMDB	Sugimoto et al. (2013) Physiological and environmental parameters associated with mass spectrometry-based salivary metabolomic profiles.
Human Saliva	Detected and Quantified	0.282	0.623	uM	Adult (>18 years old)	Not Specified	Normal	HMDB	Sugimoto et al. (2013) Physiological and environmental parameters associated with mass spectrometry-based salivary metabolomic profiles.
Human Saliva	Detected and Quantified	0.326	0.327	uM	Adult (>18 years old)	Not Specified	Normal	HMDB	Sugimoto et al. (2013) Physiological and environmental parameters associated with mass spectrometry-based salivary metabolomic profiles.
Human Placenta	Detected but not Quantified				Not Specified	Not Specified	Normal	HMDB	34986597

External Links

HMDB ID

HMDB0001367

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FooDB ID

KNApSAcK ID

Chemspider ID

KEGG Compound ID

BioCyc ID

N-ACETYL-D-GLUCOSAMINE-1-P

BiGG ID

43457

Wikipedia Link

Not Available

METLIN ID

6194

PubChem Compound

440272

PDB ID

Not Available

ChEBI ID

7125

Food Biomarker Ontology

Not Available

CMMC Knowledgebase

Not Available

General References

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 ]

Showing metabocard for N-Acetyl-glucosamine 1-phosphate (MMDBc0029632)

MOL for #<Metabolite:0x00007f9acace8c60>

3D MOL for #<Metabolite:0x00007f9acace8c60>

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PDB for #<Metabolite:0x00007f9acace8c60>

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SMILES for #<Metabolite:0x00007f9acace8c60>

INCHI for #<Metabolite:0x00007f9acace8c60>

Structure for #<Metabolite:0x00007f9acace8c60>

3D Structure for #<Metabolite:0x00007f9acace8c60>