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CHEBI:140424 - A-232 nerve agent

ChEBI IDCHEBI:140424
ChEBI NameA-232 nerve agent
Stars
DefinitionA carboxamidine that is N,N-diethylethanimidamide in which the hydrogen attached to the imino nitrogen has been replaced by a fluoro(methoxy)phosphoryl group. A toxic nerve agent developed by the former Soviet Union.
Last Modified15 March 2018
SubmitterGareth Owen
DownloadsMolfile
FormulaC7H16FN2O2P
Net Charge0
Average Mass210.189
Monoisotopic Mass210.09334
SMILESCCN(CC)C(C)=NP(=O)(F)OC
InChIInChI=1S/C7H16FN2O2P/c1-5-10(6-2)7(3)9-13(8,11)12-4/h5-6H2,1-4H3
InChIKeyBBTXAVJVSQSXHZ-UHFFFAOYSA-N
Roles Classification
Biological Roles:
neurotoxin  A poison that interferes with the functions of the nervous system.
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.
ChEBI Ontology
Outgoing Relation(s)
A-232 nerve agent (CHEBI:140424) has role EC 3.1.1.7 (acetylcholinesterase) inhibitor (CHEBI:38462)
A-232 nerve agent (CHEBI:140424) has role neurotoxin (CHEBI:50910)
A-232 nerve agent (CHEBI:140424) is a carboxamidine (CHEBI:35359)
A-232 nerve agent (CHEBI:140424) is a fluorine molecular entity (CHEBI:24062)
A-232 nerve agent (CHEBI:140424) is a organic phosphoramidate (CHEBI:37773)
IUPAC Name 
methyl N-[1-(diethylamino)ethylidene]phosphoramidofluoridate
Synonym  Source
A-232ChEBI