selegiline hydrochloride (CHEBI:9087)

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ChEBI Name	selegiline hydrochloride

ChEBI ID	CHEBI:9087

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

Formulae

C13H17N.HCl
C13H18NCl

Net Charge

Average Mass

223.74146

Monoisotopic Mass

223.11278

InChI

InChI=1S/C13H17N.ClH/c1-4-10-14(3)12(2)11-13-8-6-5-7-9-13;/h1,5-9,12H,10-11H2,2-3H3;1H/t12-;/m1./s1

InChIKey

IYETZZCWLLUHIJ-UTONKHPSSA-N

SMILES

[Cl-].[H][N+](C)(CC#C)[C@H](C)Cc1ccccc1

Roles Classification
Biological Role(s):	dopaminergic agent A drug used for its effects on dopamine receptors, on the life cycle of dopamine, or on the survival of dopaminergic neurons. EC 1.4.3.4 (monoamine oxidase) inhibitor An EC 1.4.3.* (oxidoreductase acting on donor CH-NH2 group, oxygen as acceptor) inhibitor that interferes with the action of monoamine oxidase (EC 1.4.3.4).

Application(s):	antiparkinson drug A drug used in the treatment of Parkinson's disease. dopaminergic agent A drug used for its effects on dopamine receptors, on the life cycle of dopamine, or on the survival of dopaminergic neurons.

ChEBI Ontology
Outgoing	selegiline hydrochloride (CHEBI:9087) has part (−)-selegiline(1+) (CHEBI:50350) selegiline hydrochloride (CHEBI:9087) has role antiparkinson drug (CHEBI:48407) selegiline hydrochloride (CHEBI:9087) has role dopaminergic agent (CHEBI:48560) selegiline hydrochloride (CHEBI:9087) has role EC 1.4.3.4 (monoamine oxidase) inhibitor (CHEBI:38623) selegiline hydrochloride (CHEBI:9087) is a hydrochloride (CHEBI:36807) selegiline hydrochloride (CHEBI:9087) is a terminal acetylenic compound (CHEBI:73477)

IUPAC Name

N-methyl-N-[(1R)-1-methyl-2-phenylethyl]prop-2-yn-1-aminium chloride

INN	Source
selegiline hydrochloride	ChEBI

Synonyms	Sources
(−)-phenylisopropylmethylpropynylamine	ChemIDplus
Selegiline HCl	ChemIDplus
Selegiline hydrochloride	KEGG COMPOUND

Last Modified

28 July 2014