CHEBI:38954 - temephos

ChEBI IDCHEBI:38954
ChEBI Nametemephos
Stars
DefinitionAn organic sulfide that is diphenyl sulfide in which the hydrogen at the para position of each of the phenyl groups has been replaced by a (dimethoxyphosphorothioyl)oxy group.
Last Modified15 December 2016
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC16H20O6P2S3
Net Charge0
Average Mass466.479
Monoisotopic Mass465.98972
SMILESCOP(=S)(OC)Oc1ccc(Sc2ccc(OP(=S)(OC)OC)cc2)cc1
InChIInChI=1S/C16H20O6P2S3/c1-17-23(25,18-2)21-13-5-9-15(10-6-13)27-16-11-7-14(8-12-16)22-24(26,19-3)20-4/h5-12H,1-4H3
InChIKeyWWJZWCUNLNYYAU-UHFFFAOYSA-N
Roles Classification
Biological Role:
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.
Applications:
agrochemical  An agrochemical is a substance that is used in agriculture or horticulture.
acaricide  A substance used to destroy pests of the subclass Acari (mites and ticks).
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.
pesticide  Strictly, a substance intended to kill pests. In common usage, any substance used for controlling, preventing, or destroying animal, microbiological or plant pests.
pesticide  Strictly, a substance intended to kill pests. In common usage, any substance used for controlling, preventing, or destroying animal, microbiological or plant pests.
ChEBI Ontology
Outgoing Relation(s)
temephos (CHEBI:38954) has functional parent 4,4'-thiodiphenol (CHEBI:38957)
temephos (CHEBI:38954) has role acaricide (CHEBI:22153)
temephos (CHEBI:38954) has role agrochemical (CHEBI:33286)
temephos (CHEBI:38954) has role EC 3.1.1.7 (acetylcholinesterase) inhibitor (CHEBI:38462)
temephos (CHEBI:38954) has role ectoparasiticide (CHEBI:38956)
temephos (CHEBI:38954) is a organic sulfide (CHEBI:16385)
temephos (CHEBI:38954) is a organic thiophosphate (CHEBI:37512)
temephos (CHEBI:38954) is a organothiophosphate insecticide (CHEBI:25715)
IUPAC Name 
O,O,O',O'-tetramethyl O,O'-(sulfanediyldibenzene-4,1-diyl) bis(phosphorothioate)
Synonyms  Source
O,O,O',O'-tetramethyl O,O'-(sulfanediyldibenzene-4,1-diyl) bis(thiophosphate)IUPAC
O,O'-(Thiodi-p-phenylene) O,O,O',O'-tetramethyl bis(phosphorothioate)ChemIDplus
AbateChemIDplus
Phosphorothioic acid, O,O'-(thiodi-4,1-phenylene) O,O,O',O'-tetramethyl esterChemIDplus
temefosAlan Wood's Pesticides
O,O,O',O'-tetramethyl O,O'-(sulfanediyldi-4,1-phenylene) bis(phosphorothioate)Alan Wood's Pesticides
Manual XrefsDatabases
D06062KEGG DRUG
C18809KEGG COMPOUND
LSM-3148LINCS
temephosAlan Wood's Pesticides
618PPDB
618VSDB
Registry NumbersSources
Beilstein:1896901Beilstein
CAS:3383-96-8ChemIDplus
CAS:3383-96-8NIST Chemistry WebBook
CAS:3383-96-8KEGG COMPOUND
CAS:3383-96-8Alan Wood's Pesticides
Citations