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CHEBI:34761 - fenthion

Default Structure
ChEBI IDCHEBI:34761
ChEBI Namefenthion
Stars
DefinitionAn organic thiophosphate that is O,O-dimethyl hydrogen phosphorothioate in which the hydrogen atom of the hydroxy group is replaced by a 3-methyl-4-(methylsulfanyl)phenyl group. It exhibits acaricidal and insecticidal activities.
Last Modified25 February 2016
DownloadsMolfile
FormulaC10H15O3PS2
Net Charge0
Average Mass278.335
Monoisotopic Mass278.02002
SMILESCOP(=S)(OC)Oc1ccc(SC)c(C)c1
InChIInChI=1S/C10H15O3PS2/c1-8-7-9(5-6-10(8)16-4)13-14(15,11-2)12-3/h5-7H,1-4H3
InChIKeyPNVJTZOFSHSLTO-UHFFFAOYSA-N
Wikipedia
Roles Classification
Biological Roles:
EC 3.1.1.7 (acetylcholinesterase) inhibitor  An EC 3.1.1.* (carboxylic ester hydrolase) inhibitor that interferes with the action of enzyme acetylcholinesterase (EC 3.1.1.7), which helps breaking down of acetylcholine into choline and acetic acid.
EC 3.1.1.8 (cholinesterase) inhibitor  An EC 3.1.1.* (carboxylic ester hydrolase) inhibitor that interferes with the action of cholinesterase (EC 3.1.1.8).
Applications:
acaricide  A substance used to destroy pests of the subclass Acari (mites and ticks).
agrochemical  An agrochemical is a substance that is used in agriculture or horticulture.
avicide  A substance used to destroy bird pests (class Aves).
insecticide  Strictly, a substance intended to kill members of the class Insecta. In common usage, any substance used for preventing, destroying, repelling or controlling insects.
ChEBI Ontology
Outgoing Relation(s)
fenthion (CHEBI:34761) has functional parent 4-(methylsulfanyl)-m-cresol (CHEBI:38681)
fenthion (CHEBI:34761) has role acaricide (CHEBI:22153)
fenthion (CHEBI:34761) has role agrochemical (CHEBI:33286)
fenthion (CHEBI:34761) has role avicide (CHEBI:33289)
fenthion (CHEBI:34761) has role EC 3.1.1.7 (acetylcholinesterase) inhibitor (CHEBI:38462)
fenthion (CHEBI:34761) has role EC 3.1.1.8 (cholinesterase) inhibitor (CHEBI:37733)
fenthion (CHEBI:34761) has role insecticide (CHEBI:24852)
fenthion (CHEBI:34761) is a organic thiophosphate (CHEBI:37512)
IUPAC Name 
O,O-dimethyl O-[3-methyl-4-(methylsulfanyl)phenyl] phosphorothioate
Synonyms  Source
4-Methylmercapto-3-methylphenyl dimethyl thiophosphateKEGG COMPOUND
O,O-dimethyl O-[3-methyl-4-(methylsulfanyl)phenyl] thiophosphateIUPAC
FenthionKEGG COMPOUND
MercaptophosChemIDplus
MPPKEGG COMPOUND
NSC-755881ChEMBL
Brand Names  Source
Pro-spotChEMBL
SpottonChEMBL
TiguvonChEMBL
Manual XrefsDatabases
310PPDB
310VSDB
C14420KEGG COMPOUND
D07950KEGG DRUG
FenthionWikipedia
HMDB0033209HMDB
LSM-25615LINCS
Registry NumbersSources
Reaxys:1974129Reaxys
CAS:55-38-9KEGG COMPOUND
CAS:55-38-9NIST Chemistry WebBook
CAS:55-38-9ChemIDplus
Citations