KEGG   COMPOUND: C06720
Entry
C06720                      Compound                               
Name
1,6-Dihydroxy-5-methylcyclohexa-2,4-dienecarboxylate;
1,2-Dihydroxy-3-methylcyclohexa-3,5-dienecarboxylate
Formula
C8H10O4
Exact mass
170.0579
Mol weight
170.16
Structure
Reaction
R05309 R05665
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.-         1.14.12.-
Other DBs
PubChem: 8943
ChEBI: 17641
NIKKAJI: J2.368.058K
LinkDB
KCF data

ATOM        12
            1   C1z C    26.2549  -19.9908
            2   C1y C    27.5156  -20.5997
            3   C2x C    25.0745  -20.6645
            4   C2y C    27.5044  -22.0714
            5   O1a O    28.8457  -19.9022
            6   C2x C    25.0937  -22.0730
            7   C2x C    26.3239  -22.7450
            8   C1a C    28.7651  -22.6803
            9   O1a O    27.4982  -18.8510
            10  C6a C    26.2549  -18.5908
            11  O6a O    27.4510  -17.6206
            12  O6a O    25.0516  -17.8962
BOND        12
            1     1   2 1
            2     1   3 1
            3     2   4 1
            4     2   5 1 #Up
            5     3   6 2
            6     4   7 2
            7     4   8 1
            8     6   7 1
            9     1   9 1 #Up
            10    1  10 1
            11   10  11 1
            12   10  12 2

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