CHEBI:50217 - selegiline

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ChEBI Name selegiline
ChEBI ID CHEBI:50217
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C13H17N
Net Charge 0
Average Mass 187.28082
Monoisotopic Mass 187.136
InChI InChI=1S/C13H17N/c1-4-10-14(3)12(2)11-13-8-6-5-7-9-13/h1,5-9,12H,10-11H2,2-3H3
InChIKey MEZLKOACVSPNER-UHFFFAOYSA-N
SMILES CC(Cc1ccccc1)N(C)CC#C
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via alkaloid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing selegiline (CHEBI:50217) is a phenethylamine alkaloid (CHEBI:38605)
selegiline (CHEBI:50217) is a terminal acetylenic compound (CHEBI:73477)
selegiline (CHEBI:50217) is a tertiary amine (CHEBI:32876)
selegiline (CHEBI:50217) is conjugate base of selegiline(1+) (CHEBI:51099)
Incoming (−)-selegiline (CHEBI:9086) is a selegiline (CHEBI:50217)
selegiline(1+) (CHEBI:51099) is conjugate acid of selegiline (CHEBI:50217)
IUPAC Name
N-methyl-N-(1-methyl-2-phenylethyl)prop-2-yn-1-amine
INNs Sources
selegilina ChEBI
sélégiline ChEBI
selegiline ChEBI
selegilinum ChEBI
Manual Xref Database
DB01037 DrugBank
View more database links
Registry Number Type Source
2092580 Beilstein Registry Number Beilstein
Last Modified
02 May 2013