KEGG   COMPOUND: C03434
Entry
C03434                      Compound                               
Name
Tetrachlorohydroquinone;
2,3,5,6-Tetrachlorohydroquinone
Formula
C6H2Cl4O2
Exact mass
245.8809
Mol weight
247.8909
Structure
Reaction
Pathway
map00361  Chlorocyclohexane and chlorobenzene degradation
map01100  Metabolic pathways
map01120  Microbial metabolism in diverse environments
map05208  Chemical carcinogenesis - reactive oxygen species
Network
nt06251  CYP-mediated ROS formation (cancer)
Enzyme
1.1.1.404       1.14.13.50      1.21.4.5
Other DBs
CAS: 87-87-6
PubChem: 6261
ChEBI: 17042
KNApSAcK: C00007485
3DMET: B00583
NIKKAJI: J54.019F
KCF data

ATOM        12
            1   C8y C    28.8337  -18.3569
            2   C8y C    27.6284  -17.6452
            3   C8y C    30.0581  -17.6452
            4   O1a O    28.8337  -19.7480
            5   C8y C    27.6284  -16.2348
            6   X   Cl   26.4165  -18.3376
            7   C8y C    30.0581  -16.2348
            8   X   Cl   31.2698  -18.3376
            9   C8y C    28.8337  -15.5359
            10  X   Cl   26.4230  -15.5359
            11  X   Cl   31.2635  -15.5359
            12  O1a O    28.8337  -14.1447
BOND        12
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 2
            7     3   8 1
            8     5   9 2
            9     5  10 1
            10    7  11 1
            11    9  12 1
            12    7   9 1

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