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CHEBI:233582 - methoxime

ChEBI IDCHEBI:233582
ChEBI Namemethoxime
Stars
SubmitterFlyBase
DownloadsMolfile
FormulaC13H13N4O2.HCl
Net Charge+1
Average Mass293.734
Monoisotopic Mass293.07998
SMILESCl.O=NC=C1C=CN(CN2C=CC(=C[NH+]=O)C=C2)C=C1
InChIInChI=1S/C13H12N4O2.ClH/c18-14-9-12-1-5-16(6-2-12)11-17-7-3-13(4-8-17)10-15-19;/h1-10H,11H2;1H/p+1
InChIKeyQOWOXBFFQOXPHM-UHFFFAOYSA-O
Roles Classification
Biological Role:
cholinesterase reactivator  A drug used to reverse the inactivation of cholinesterase caused by organophosphates or sulfonates.
ChEBI Ontology
Outgoing Relation(s)
methoxime (CHEBI:233582) has role cholinesterase reactivator (CHEBI:50241)
methoxime (CHEBI:233582) is a organic molecular entity (CHEBI:50860)
IUPAC Name 
(NE)-N-[[1-[[4-[(E)-hydroxyiminomethyl]pyridin-1-ium-1-yl]methyl]pyridin-1-ium-4-yl]methylidene]hydroxylamine;chloride
Synonym  Source
N,N'-monomethylenebis(pyridiniumaldoxime)SUBMITTER
Registry NumbersSources
CAS:51026-61-0SUBMITTER
Citations