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CHEBI:51025 - methixene hydrochloride

Default Structure
ChEBI IDCHEBI:51025
ChEBI Namemethixene hydrochloride
Stars
Secondary ChEBI IDCHEBI:31829
Last Modified6 March 2017
SubmitterInma Spiteri
DownloadsMolfile
FormulaH.C20H23NS.Cl.H2O
Net Charge0
Average Mass363.954
Monoisotopic Mass363.14236
SMILESCN1CCCC(CC2c3ccccc3Sc3ccccc32)C1.O.[Cl-].[H+]
InChIInChI=1S/C20H23NS.ClH.H2O/c1-21-12-6-7-15(14-21)13-18-16-8-2-4-10-19(16)22-20-11-5-3-9-17(18)20;;/h2-5,8-11,15,18H,6-7,12-14H2,1H3;1H;1H2
InChIKeyRAOHHYUBMJLHNC-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
methixene hydrochloride (CHEBI:51025) has part metixene (CHEBI:51024)
methixene hydrochloride (CHEBI:51025) is a hydrate (CHEBI:35505)
methixene hydrochloride (CHEBI:51025) is a hydrochloride (CHEBI:36807)
IUPAC Name 
1-methyl-3-(9H-thioxanthen-9-ylmethyl)piperidine hydrochloride monohydrate
Synonyms  Source
1-Methyl-3-(thioxanthen-9-ylmethyl)piperidine hydrochloride monohydrateChemIDplus
Anhydrous metixene hydrochlorideChEMBL
Methixene HClChemIDplus
Methixene hydrochloride anhydrousChEMBL
Methixene hydrochloride hydrateKEGG DRUG
Metixene hydrochloride anhydrousChEMBL
Brand Names  Source
TremaritChEMBL
TrestChEMBL
Manual XrefsDatabases
D01871KEGG DRUG
DB00340DrugBank
Registry NumbersSources
CAS:7081-40-5ChemIDplus