KEGG   COMPOUND: C07098
Entry
C07098                      Compound                               
Name
2,4,6-Trichlorophenol
Formula
C6H3Cl3O
Exact mass
195.9249
Mol weight
197.44
Structure
Reaction
R05449 R05754 R13143
Pathway
map00361  Chlorocyclohexane and chlorobenzene degradation
map01120  Microbial metabolism in diverse environments
Enzyme
1.14.14.173     2.1.1.136
Other DBs
CAS: 88-06-2
PubChem: 9309
ChEBI: 28755
PDB-CCD: T6C[PDBj]
NIKKAJI: J3.543B
LinkDB
KCF data

ATOM        10
            1   C8y C    28.0000  -18.1321
            2   C8y C    26.7884  -18.8286
            3   C8y C    29.2116  -18.8286
            4   O1a O    28.0058  -16.7274
            5   C8x C    26.7884  -20.2275
            6   X   Cl   25.5711  -18.1262
            7   C8x C    29.2116  -20.2275
            8   X   Cl   30.4231  -18.1321
            9   C8y C    28.0000  -20.9299
            10  X   Cl   28.0058  -22.3286
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     3   8 1
            8     5   9 1
            9     9  10 1
            10    7   9 2

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