omethoate (CHEBI:38730)

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ChEBI Name	omethoate

ChEBI ID	CHEBI:38730

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information	ChemicalBook:CB6376936, eMolecules:3716398, ZINC000169794506

Download	Molfile XML SDF

Formula

C5H12NO4PS

Net Charge

Average Mass

213.19288

Monoisotopic Mass

213.02247

InChI

InChI=1S/C5H12NO4PS/c1-6-5(7)4-12-11(8,9-2)10-3/h4H2,1-3H3,(H,6,7)

InChIKey

PZXOQEXFMJCDPG-UHFFFAOYSA-N

SMILES

CNC(=O)CSP(=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 )

ChEBI Ontology
Outgoing	omethoate (CHEBI:38730) has functional parent N-methyl-2-sulfanylacetamide (CHEBI:38731) omethoate (CHEBI:38730) has role acaricide (CHEBI:22153) omethoate (CHEBI:38730) has role agrochemical (CHEBI:33286) omethoate (CHEBI:38730) has role EC 3.1.1.7 (acetylcholinesterase) inhibitor (CHEBI:38462) omethoate (CHEBI:38730) is a organic thiophosphate (CHEBI:37512) omethoate (CHEBI:38730) is a organothiophosphate insecticide (CHEBI:25715)

IUPAC Name

O,O-dimethyl S-[2-(methylamino)-2-oxoethyl] phosphorothioate

Synonyms	Sources
2-Dimethoxyphosphinoylthio-N-methylacetamide	ChemIDplus
Dimethoxon	ChemIDplus
O,O-Dimethyl S-((methylcarbamoyl)methyl)phosphorothioate	ChemIDplus
O,O-Dimethyl S-(N-methylcarbamoylmethyl) phosphorothiolate	ChemIDplus
O,O-Dimethyl S-(N-methylcarbamoylmethyl) thiophosphate	ChemIDplus
O,O-Dimethyl S-[(methylcarbamoyl)methyl] phosphorothioate	NIST Chemistry WebBook
O,O-dimethyl S-[2-(methylamino)-2-oxoethyl] thiophosphate	IUPAC
O,O-Dimethyl-S-(N-methylcarbamoylmethyl)phosphorothioate	ChemIDplus
Phosphorothioic acid, O,O-dimethyl S-(2-(methylamino)-2-oxoethyl) ester	ChemIDplus

Last Modified

28 July 2014