CHEBI:38812 - phoxim

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ChEBI Name phoxim
ChEBI ID CHEBI:38812
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C12H15N2O3PS
Net Charge 0
Average Mass 298.29894
Monoisotopic Mass 298.054
InChI InChI=1S/C12H15N2O3PS/c1-3-15-18(19,16-4-2)17-14-12(10-13)11-8-6-5-7-9-11/h5-9H,3-4H2,1-2H3/b14-12-
InChIKey ATROHALUCMTWTB-OWBHPGMISA-N
SMILES CCOP(=S)(OCC)O\N=C(\C#N)c1ccccc1
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.
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).
Application(s): 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 phoxim (CHEBI:38812) has functional parent (hydroxyimino)(phenyl)acetonitrile (CHEBI:38842)
phoxim (CHEBI:38812) has role agrochemical (CHEBI:33286)
phoxim (CHEBI:38812) has role EC 3.1.1.7 (acetylcholinesterase) inhibitor (CHEBI:38462)
phoxim (CHEBI:38812) has role EC 3.1.1.8 (cholinesterase) inhibitor (CHEBI:37733)
phoxim (CHEBI:38812) is a organic thiophosphate (CHEBI:37512)
phoxim (CHEBI:38812) is a organothiophosphate insecticide (CHEBI:25715)
IUPAC Name
O-{[cyano(phenyl)methylidene]amino} O,O-diethyl phosphorothioate
Synonyms Sources
α-(((Diethoxyphosphinothioyl)oxy)imino)benzeneacetonitrile NIST Chemistry WebBook
O,O-Diethyl-α-cyanobenzylidineaminooxyphosphonothiate NIST Chemistry WebBook
O-(α-cyanobenzylideneamino) O,O-diethyl thiophosphate ChEBI
O-{[cyano(phenyl)methylidene]amino} O,O-diethyl thiophosphate IUPAC
Phenylglyoxylnitrile oxime O,O-diethyl phosphorothioate ChemIDplus
Manual Xrefs Databases
C18757 KEGG COMPOUND
D08373 KEGG DRUG
View more database links
Registry Numbers Types Sources
14816-18-3 CAS Registry Number ChemIDplus
14816-18-3 CAS Registry Number NIST Chemistry WebBook
2995646 Beilstein Registry Number Beilstein
Last Modified
04 August 2014