KEGG   COMPOUND: C02137Help
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
150.1314
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00360  Phenylalanine metabolism
map00627  Aminobenzoate degradation
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
ChEMBL: CHEMBL950
PDB-CCD: 173[PDBj]
3DMET: B00392
NIKKAJI: J2.992K
LinkDB All DBs
KCF data Show

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

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