CHEBI:38624 - demeton-S-methyl

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ChEBI Name demeton-S-methyl
ChEBI ID CHEBI:38624
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C6H15O3PS2
Net Charge 0
Average Mass 230.28726
Monoisotopic Mass 230.020
InChI InChI=1S/C6H15O3PS2/c1-4-11-5-6-12-10(7,8-2)9-3/h4-6H2,1-3H3
InChIKey WEBQKRLKWNIYKK-UHFFFAOYSA-N
SMILES CCSCCSP(=O)(OC)OC
Roles Classification
Biological Role(s): 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.
Application(s): 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.
(via organophosphorus insecticide )
pesticide
Strictly, a substance intended to kill pests. In common usage, any substance used for controlling, preventing, or destroying animal, microbiological or plant pests.
(via organophosphorus pesticide )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing demeton-S-methyl (CHEBI:38624) has functional parent 2-(ethylsulfanyl)ethanethiol (CHEBI:38625)
demeton-S-methyl (CHEBI:38624) has role acaricide (CHEBI:22153)
demeton-S-methyl (CHEBI:38624) has role agrochemical (CHEBI:33286)
demeton-S-methyl (CHEBI:38624) has role EC 3.1.1.7 (acetylcholinesterase) inhibitor (CHEBI:38462)
demeton-S-methyl (CHEBI:38624) is a organic thiophosphate (CHEBI:37512)
demeton-S-methyl (CHEBI:38624) is a organothiophosphate insecticide (CHEBI:25715)
IUPAC Name
S-[2-(ethylsulfanyl)ethyl] O,O-dimethyl phosphorothioate
Synonyms Sources
DSM NIST Chemistry WebBook
O,O-dimethyl S-(2-(ethylthio)ethyl)phosphorothioate ChemIDplus
O,O-dimethyl S-ethylmercaptoethyl thiophosphate ChemIDplus
phosphorothioic acid, S-[2-(ethylthio)ethyl] O,O-dimethyl ester NIST Chemistry WebBook
S-[2-(ethylsulfanyl)ethyl] O,O-dimethyl thiophosphate IUPAC
Manual Xrefs Databases
206 PPDB
C18655 KEGG COMPOUND
View more database links
Registry Numbers Types Sources
1707311 Beilstein Registry Number Beilstein
919-86-8 CAS Registry Number KEGG COMPOUND
919-86-8 CAS Registry Number NIST Chemistry WebBook
919-86-8 CAS Registry Number ChemIDplus
Last Modified
28 July 2014