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CHEBI:32226 - Timepidium bromide

Default Structure
ChEBI IDCHEBI:32226
ChEBI NameTimepidium bromide
Stars
Last Modified22 February 2017
DownloadsMolfile
FormulaBr.C17H22NOS2
Net Charge0
Average Mass400.407
Monoisotopic Mass399.03262
SMILESCOC1CC(=C(c2cccs2)c2cccs2)C[N+](C)(C)C1.[Br-]
InChIInChI=1S/C17H22NOS2.BrH/c1-18(2)11-13(10-14(12-18)19-3)17(15-6-4-8-20-15)16-7-5-9-21-16;/h4-9,14H,10-12H2,1-3H3;1H/q+1;/p-1
InChIKeyQTSXMEPZSHLZFF-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
Timepidium bromide (CHEBI:32226) is a organic molecular entity (CHEBI:50860)
Synonyms  Source
mepidiumDrugCentral
timepidium bromideDrugCentral
Timepidium bromideKEGG COMPOUND
Timepidium bromide anhydrousKEGG COMPOUND
Manual XrefsDatabases
2667DrugCentral
C12768KEGG COMPOUND
Registry NumbersSources
CAS:35035-05-3KEGG COMPOUND