COMPOUND: C07099
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Entry
C07099 Compound
Name
2,3,6-Trichlorohydroquinone
Formula
C6H3Cl3O2
Exact mass
211.9199
Mol weight
213.44
Structure
Mol file
KCF file
DB search
Reaction
R05402
R05403
Pathway
map00361
Chlorocyclohexane and chlorobenzene degradation
map01100
Metabolic pathways
map01120
Microbial metabolism in diverse environments
Enzyme
1.21.4.5
Other DBs
CAS:
608-94-6
PubChem:
9310
ChEBI:
28263
KNApSAcK:
C00007486
NIKKAJI:
J134.552D
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KCF data
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ATOM 11
1 C8y C 27.6350 -16.2265
2 C8y C 28.8523 -15.5241
3 C8y C 27.6350 -17.6252
4 X Cl 26.4235 -15.5241
5 C8y C 30.0581 -16.2265
6 O1a O 28.8523 -14.1252
7 C8y C 28.8523 -18.3276
8 X Cl 26.4235 -18.3276
9 C8x C 30.0581 -17.6252
10 X Cl 31.2754 -15.5299
11 O1a O 28.8523 -19.7263
BOND 11
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 3 8 1
8 5 9 1
9 5 10 1
10 7 11 1
11 7 9 2
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