KEGG   COMPOUND: C02137
Entry
C02137                      Compound                               
Name
alpha-Oxo-benzeneacetic acid;
Benzoylformate;
Benzoylformic acid;
Phenylglyoxylic acid;
Phenylglyoxylate;
2-Oxo-2-phenylacetate
Formula
C8H6O3
Exact mass
150.0317
Mol weight
150.13
Structure
Reaction
R01764 R02450 R03790 R03792 R03793 R07294 R07664
Pathway
map00360  Phenylalanine metabolism
map00627  Aminobenzoate degradation
map01100  Metabolic pathways
map01120  Microbial metabolism in diverse environments
Enzyme
1.1.1.379       1.1.1.-         1.1.99.31       1.2.1.58        
3.1.2.25        4.1.1.7
Other DBs
CAS: 611-73-4
PubChem: 5216
ChEBI: 18280
PDB-CCD: 173[PDBj]
NIKKAJI: J2.992K
KCF data

ATOM        11
            1   C8y C    17.8032  -15.0958
            2   C5a C    17.7969  -13.6992
            3   C8x C    16.5924  -15.7942
            4   C8x C    19.0205  -15.7942
            5   C6a C    19.0014  -13.0008
            6   O5a O    16.5861  -13.0073
            7   C8x C    16.5924  -17.2036
            8   C8x C    19.0205  -17.2036
            9   O6a O    20.2057  -13.6992
            10  O6a O    18.9949  -11.6105
            11  C8x C    17.8032  -17.9147
BOND        11
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 1
            5     2   6 2
            6     3   7 1
            7     4   8 2
            8     5   9 1
            9     5  10 2
            10    7  11 2
            11    8  11 1

» Japanese version

  All links  
Chemical substance (11)   
   PubChem (1)   
   ChEBI (1)   
   HMDB (1)   
   MASSBANK (6)   
   NIKKAJI (1)   
   PDB-CCD (1)   
All databases (11)   

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