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CHEBI:140423 - A-230 nerve agent

ChEBI IDCHEBI:140423
ChEBI NameA-230 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DefinitionA carboxamidine that is N,N-diethylethanimidamide in which the hydrogen attached to the imino nitrogen has been replaced by a fluoro(methyl)phosphoryl group. A toxic nerve agent developed by the former Soviet Union.
Last Modified15 March 2018
SubmitterGareth Owen
DownloadsMolfile
FormulaC7H16FN2OP
Net Charge0
Average Mass194.190
Monoisotopic Mass194.09843
SMILESCCN(CC)C(C)=NP(C)(=O)F
InChIInChI=1S/C7H16FN2OP/c1-5-10(6-2)7(3)9-12(4,8)11/h5-6H2,1-4H3
InChIKeyOUJDIWHRYQBZSR-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-230 nerve agent (CHEBI:140423) has role EC 3.1.1.7 (acetylcholinesterase) inhibitor (CHEBI:38462)
A-230 nerve agent (CHEBI:140423) has role neurotoxin (CHEBI:50910)
A-230 nerve agent (CHEBI:140423) is a carboxamidine (CHEBI:35359)
A-230 nerve agent (CHEBI:140423) is a fluorine molecular entity (CHEBI:24062)
A-230 nerve agent (CHEBI:140423) is a organic phosphoramidate (CHEBI:37773)
IUPAC Name 
N-[1-(diethylamino)ethylidene]-P-methylphosphonamidic fluoride
Synonym  Source
A-230ChEBI