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CHEBI:31526 - (S)-duloxetine hydrochloride

ChEBI IDCHEBI:31526
ChEBI Name(S)-duloxetine hydrochloride
Stars
ASCII Name(S)-duloxetine hydrochloride
DefinitionA duloxetine hydrochloride in which the duloxetine moiety has S configuration.
Last Modified17 August 2011
DownloadsMolfile
FormulaC18H19NOS.HCl
Net Charge0
Average Mass333.884
Monoisotopic Mass333.09541
SMILESCNCC[C@H](Oc1cccc2ccccc12)c1cccs1.Cl
InChIInChI=1S/C18H19NOS.ClH/c1-19-12-11-17(18-10-5-13-21-18)20-16-9-4-7-14-6-2-3-8-15(14)16;/h2-10,13,17,19H,11-12H2,1H3;1H/t17-;/m0./s1
InChIKeyBFFSMCNJSOPUAY-LMOVPXPDSA-N
Roles Classification
Application:
antidepressant  Antidepressants are mood-stimulating drugs used primarily in the treatment of affective disorders and related conditions.
ChEBI Ontology
Outgoing Relation(s)
(S)-duloxetine hydrochloride (CHEBI:31526) has part (S)-duloxetine (CHEBI:36795)
(S)-duloxetine hydrochloride (CHEBI:31526) has role antidepressant (CHEBI:35469)
(S)-duloxetine hydrochloride (CHEBI:31526) is a duloxetine hydrochloride (CHEBI:36808)
IUPAC Name 
(3S)-N-methyl-3-(naphthalen-1-yloxy)-3-(2-thienyl)propan-1-amine hydrochloride
Synonyms  Source
duloxetine hydrochlorideChemIDplus
CymbaltaChemIDplus
(3S)-N-methyl-3-(1-naphthyloxy)-3-(2-thienyl)propan-1-amine hydrochlorideIUPAC
Manual XrefsDatabases
D01179KEGG DRUG
Registry NumbersSources
Reaxys:8168890Reaxys
CAS:136434-34-9ChemIDplus