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CHEBI:34520 - acephate

ChEBI IDCHEBI:34520
ChEBI Nameacephate
Stars
DefinitionA phosphoramide that is methamidophos in which one of the hydrogens is replaced by an acetyl group.
Last Modified24 February 2014
DownloadsMolfile
FormulaC4H10NO3PS
Net Charge0
Average Mass183.169
Monoisotopic Mass183.01190
SMILESCOP(=O)(NC(C)=O)SC
InChIInChI=1S/C4H10NO3PS/c1-4(6)5-9(7,8-2)10-3/h1-3H3,(H,5,6,7)
InChIKeyYASYVMFAVPKPKE-UHFFFAOYSA-N
Wikipedia
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:
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.
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)
acephate (CHEBI:34520) has functional parent methamidophos (CHEBI:38721)
acephate (CHEBI:34520) has role acaricide (CHEBI:22153)
acephate (CHEBI:34520) has role agrochemical (CHEBI:33286)
acephate (CHEBI:34520) has role EC 3.1.1.7 (acetylcholinesterase) inhibitor (CHEBI:38462)
acephate (CHEBI:34520) is a mixed diacylamine (CHEBI:37716)
acephate (CHEBI:34520) is a organic thiophosphate (CHEBI:37512)
acephate (CHEBI:34520) is a organothiophosphate insecticide (CHEBI:25715)
acephate (CHEBI:34520) is a phosphoramide (CHEBI:17102)
IUPAC Name 
O,S-dimethyl acetylphosphoroamidothioate
Synonyms  Source
AcephateKEGG COMPOUND
AcetamidophosChemIDplus
Acetylphosphoramidothioic acid O,S-dimethyl esterChemIDplus
O,S-dimethyl acetylamidothiophosphateIUPAC
N-(Methoxy(methylthio)phosphinoyl)acetamideChemIDplus
O,S-DimethylacetylphosphoroamidothioateKEGG COMPOUND
Manual XrefsDatabases
9PPDB
AcephateWikipedia
C14426KEGG COMPOUND
CN102989760Patent
CN102993230Patent
Registry NumbersSources
Reaxys:1936365Reaxys
CAS:30560-19-1NIST Chemistry WebBook
CAS:30560-19-1KEGG COMPOUND
CAS:30560-19-1ChemIDplus
Citations