KEGG   COMPOUND: C06729Help
Entry
C06729                      Compound                               

Name
cis-1,2-Dihydroxy-4-methylcyclohexa-3,5-diene-1-carboxylate;
4-Methylcyclohexa-3,5-diene-1,2-cis-diol-1-carboxylic acid
Formula
C8H10O4
Exact mass
170.0579
Mol weight
170.1626
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00622  Xylene degradation
map01100  Metabolic pathways
map01120  Microbial metabolism in diverse environments
map01220  Degradation of aromatic compounds
Module
M00551  Benzoate degradation, benzoate => catechol / methylbenzoate => methylcatechol
Enzyme
1.3.1.67        1.14.12.-
Other DBs
PubChem: 8951
ChEBI: 17095
NIKKAJI: J2.368.064E
KCF data Show

ATOM        12
            1   C1z C    25.8595  -20.5683
            2   C1y C    27.0722  -19.8863
            3   C2x C    25.8421  -21.9733
            4   C6a C    24.6527  -19.8630
            5   O1a O    25.8537  -19.1751
            6   C2x C    28.2790  -20.5974
            7   O1a O    27.0838  -18.4929
            8   C2x C    27.0429  -22.6904
            9   O6a O    23.4285  -20.5450
            10  O6a O    24.6644  -18.4579
            11  C2y C    28.2673  -21.9966
            12  C1a C    29.4741  -22.7195
BOND        12
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     1   5 1
            5     2   6 1
            6     2   7 1
            7     3   8 2
            8     4   9 1
            9     4  10 2
            10    6  11 2
            11   11  12 1
            12    8  11 1

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