KEGG   COMPOUND: C06790Help
Entry
C06790                      Compound                               

Name
Trichloroethene;
Trichloroethylene;
TCE
Formula
C2HCl3
Exact mass
129.9144
Mol weight
131.3883
Structure
Mol fileKCF fileDB search
Remark
ATC code: N01AB05
Reaction
Pathway
map00625  Chloroalkane and chloroalkene degradation
map00980  Metabolism of xenobiotics by cytochrome P450
map01100  Metabolic pathways
map01120  Microbial metabolism in diverse environments
map05204  Chemical carcinogenesis
Enzyme
1.14.12.11      1.14.13.25      1.14.13.-       1.14.14.1       
1.14.-.-        1.21.99.5       2.5.1.18
Brite
Carcinogens [BR:br08008]
 Group 1: Carcinogenic to humans
  Compounds
   C06790  Trichloroethene
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 N NERVOUS SYSTEM
  N01 ANESTHETICS
   N01A ANESTHETICS, GENERAL
    N01AB Halogenated hydrocarbons
     N01AB05 Trichloroethylene
      C06790  Trichloroethene
BRITE hierarchy
Other DBs
CAS: 79-01-6
PubChem: 9010
ChEBI: 16602
ChEMBL: CHEMBL279816
PDB-CCD: TCV[PDBj]
3DMET: B01052
NIKKAJI: J4.408C
KCF data Show

ATOM        5
            1   C2c C    28.1347  -16.9870
            2   C2b C    29.5505  -16.9870
            3   X   Cl   27.4239  -18.1464
            4   X   Cl   27.4296  -15.7634
            5   X   Cl   30.2555  -18.2105
BOND        4
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1

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