KEGG   COMPOUND: C06727
Entry
C06727                      Compound                               
Name
cis-1,2-Dihydro-3-ethylcatechol;
cis-2,3-Dihydroxy-2,3-dihydroethylbenzene;
cis-3-Ethyl-cyclohexa-3,5-diene-1,2-diol
Formula
C8H12O2
Exact mass
140.0837
Mol weight
140.1797
Structure
Reaction
R05313 R05440
Pathway
map00642  Ethylbenzene degradation
map01100  Metabolic pathways
map01120  Microbial metabolism in diverse environments
map01220  Degradation of aromatic compounds
Enzyme
1.3.1.66        1.14.12.-
Other DBs
CAS: 66008-19-3
PubChem: 8949
ChEBI: 16843
NIKKAJI: J1.327.215H
LinkDB
KCF data

ATOM        10
            1   C2y C    28.2639  -16.5790
            2   C1y C    29.4705  -17.2844
            3   C2x C    27.0515  -17.2727
            4   C1b C    28.2698  -15.1800
            5   C1y C    29.4705  -18.6834
            6   O1a O    30.6888  -16.5907
            7   C2x C    27.0399  -18.6775
            8   C1a C    27.0690  -14.4573
            9   C2x C    28.2522  -19.3770
            10  O1a O    30.6772  -19.3886
BOND        10
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 1
            5     2   6 1 #Up
            6     3   7 1
            7     4   8 1
            8     5   9 1
            9     5  10 1 #Up
            10    7   9 2

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