KEGG   COMPOUND: C02575Help
Entry
C02575                      Compound                               

Name
Pentachlorophenol;
PCP
Formula
C6HCl5O
Exact mass
263.847
Mol weight
266.3365
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
map00361  Chlorocyclohexane and chlorobenzene degradation
map01100  Metabolic pathways
map01120  Microbial metabolism in diverse environments
Enzyme
Brite
Endocrine disrupting compounds [BR:br08006]
 Pesticides and herbicides
  Others
   C02575  Pentachlorophenol
Pesticides [BR:br08007]
 Pesticides
  Insecticides
   Organochlorine insecticides
    C02575  Pentachlorophenol
BRITE hierarchy
Other DBs
CAS: 87-86-5
PubChem: 5570
ChEBI: 17642
ChEMBL: CHEMBL75967
KNApSAcK: C00007496
PDB-CCD: PCI[PDBj]
3DMET: B00462
NIKKAJI: J3.904G
KCF data Show

ATOM        12
            1   C8y C    25.0277  -15.5767
            2   C8y C    26.2340  -16.3075
            3   C8y C    23.7955  -16.2618
            4   O1a O    25.0545  -14.1836
            5   C8y C    26.2782  -17.7235
            6   X   Cl   27.4540  -15.6300
            7   C8y C    23.7686  -17.6548
            8   X   Cl   22.6056  -15.5409
            9   C8y C    24.9749  -18.3856
            10  X   Cl   27.3979  -18.4443
            11  X   Cl   22.5463  -18.3235
            12  X   Cl   25.0091  -19.7808
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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