KEGG   COMPOUND: C06728
Entry
C06728                      Compound                               
Name
3-Ethylcatechol;
2,3-Dihydroxyethylbenzene;
3-Ethyl-benzene-1,2-diol
Formula
C8H10O2
Exact mass
138.0681
Mol weight
138.1638
Structure
Reaction
Pathway
map00642  Ethylbenzene degradation
map01100  Metabolic pathways
map01120  Microbial metabolism in diverse environments
map01220  Degradation of aromatic compounds
Enzyme
1.3.1.66        1.13.11.-
Other DBs
CAS: 933-99-3
PubChem: 8950
ChEBI: 16572
3DMET: B01035
NIKKAJI: J801.879K
KCF data

ATOM        10
            1   C8y C    28.2628  -16.5964
            2   C8y C    29.4753  -17.2843
            3   C8x C    27.0560  -17.3076
            4   C1b C    28.2452  -15.1972
            5   C8y C    29.4927  -18.6834
            6   O1a O    30.6821  -16.5730
            7   C8x C    27.0618  -18.7067
            8   C1a C    27.0327  -14.4919
            9   C8x C    28.2861  -19.3945
            10  O1a O    30.7111  -19.3713
BOND        10
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 2
            5     2   6 1
            6     3   7 1
            7     4   8 1
            8     5   9 1
            9     5  10 1
            10    7   9 2

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