KEGG   COMPOUND: C07211Help
Entry
C07211                      Compound                               

Name
m-Methylbenzoate;
m-Toluic Acid;
beta-Bethylbenzoic acid;
m-Toluylic acid
Formula
C8H8O2
Exact mass
136.0524
Mol weight
136.1479
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
M00537  Xylene degradation, xylene => methylbenzoate
M00551  Benzoate degradation, benzoate => catechol / methylbenzoate => methylcatechol
Enzyme
1.2.1.7         1.2.1.28        1.14.12.-
Other DBs
CAS: 99-04-7
PubChem: 9420
ChEBI: 10589 28795
ChEMBL: CHEMBL67450
3DMET: B01078
NIKKAJI: J47.804K
LinkDB All DBs
KCF data Show

ATOM        10
            1   C8y C    28.2499  -16.5880
            2   C8x C    29.4560  -17.2906
            3   C8x C    27.0323  -17.2906
            4   C6a C    28.2499  -15.1887
            5   C8y C    29.4560  -18.6897
            6   C8x C    27.0323  -18.6897
            7   O6a O    27.0381  -14.4862
            8   O6a O    29.4618  -14.4922
            9   C8x C    28.2499  -19.3922
            10  C1a C    30.6679  -19.3922
BOND        10
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     3   6 2
            6     4   7 1
            7     4   8 2
            8     5   9 2
            9     5  10 1
            10    6   9 1

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