KEGG   COMPOUND: C22920
Entry
C22920                      Compound                               
Name
4-Oxocyclohex-2,5-dienecarboxylate;
4-Oxocyclohexa-2,5-diene-1-carboxylic acid
Formula
C7H6O3
Exact mass
138.0317
Mol weight
138.12
Structure
Reaction
R13325 R13326
Pathway
map00362  Benzoate degradation
map01120  Microbial metabolism in diverse environments
Other DBs
PubChem: 497620271
LinkDB
KCF data

ATOM        10
            1   C1y C    18.6358  -14.8947
            2   C6a C    18.6358  -13.4830
            3   C2x C    17.4358  -15.6006
            4   C2x C    19.8358  -15.6006
            5   O6a O    19.8358  -12.7772
            6   O6a O    17.4358  -12.7772
            7   C2x C    17.4358  -17.0123
            8   C2x C    19.8358  -17.0123
            9   C5x C    18.6358  -17.7182
            10  O5x O    18.6358  -19.1299
BOND        10
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 2
            6     3   7 2
            7     4   8 2
            8     7   9 1
            9     9  10 2
            10    8   9 1

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