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CHEBI:50142 - methacholine chloride

ChEBI IDCHEBI:50142
ChEBI Namemethacholine chloride
Stars
Last Modified17 June 2008
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC8H18NO2.Cl
Net Charge0
Average Mass195.690
Monoisotopic Mass195.10261
SMILESCC(=O)OC(C)C[N+](C)(C)C.[Cl-]
InChIInChI=1S/C8H18NO2.ClH/c1-7(11-8(2)10)6-9(3,4)5;/h7H,6H2,1-5H3;1H/q+1;/p-1
InChIKeyJHPHVAVFUYTVCL-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
methacholine chloride (CHEBI:50142) has part methacholine (CHEBI:6804)
methacholine chloride (CHEBI:50142) is a quaternary ammonium salt (CHEBI:35273)
IUPAC Name 
2-acetyloxy-N,N,N-trimethylpropan-1-aminium chloride
INN  Source
methacholine chlorideKEGG DRUG
Brand Name  Source
ProvocholineKEGG DRUG
Manual XrefsDatabases
D04970KEGG DRUG