KEGG   COMPOUND: C02124Help
Entry
C02124                      Compound                               

Name
4-Chlorophenol;
p-Chlorophenol;
Parachlorophenol
Formula
C6H5ClO
Exact mass
128.0029
Mol weight
128.5563
Structure
Mol fileKCF fileDB search
Remark
Same as: D00149
Comment
2-Chlorophenol [CPD:C14219]
3-Chlorophenol [CPD:C14270]
Reaction
Pathway
map00361  Chlorocyclohexane and chlorobenzene degradation
map01100  Metabolic pathways
map01120  Microbial metabolism in diverse environments
map01220  Degradation of aromatic compounds
Enzyme
1.14.11.-       1.14.13.20
Other DBs
CAS: 106-48-9
PubChem: 5203
ChEBI: 28078
ChEMBL: CHEMBL57053
PDB-CCD: 4CH[PDBj]
3DMET: B00391
NIKKAJI: J3.611K
KCF data Show

ATOM        8
            1   C8y C    25.0600  -18.6895
            2   C8x C    23.8515  -19.3801
            3   C8x C    26.2750  -19.3801
            4   O1a O    25.0537  -17.2956
            5   C8x C    23.8515  -20.7871
            6   C8x C    26.2750  -20.7871
            7   C8y C    25.0600  -21.5033
            8   X   Cl   25.0537  -22.8907
BOND        8
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     3   6 2
            6     5   7 2
            7     7   8 1
            8     6   7 1

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