OntologiesaddictoclassesCHEBI:68641   
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(-)-cotinineImported
http://purl.obolibrary.org/obo/CHEBI_68641

An N-alkylpyrrolidine that consists of N-methylpyrrolidinone bearing a pyridin-3-yl substituent at position C-5 (the 5S-enantiomer). It is an alkaloid commonly found in Nicotiana tabacum.

Defined bychebi
Also appears inprideslmefouphenohp
Exact Synonyms
(5S)-1-methyl-5-(pyridin-3-yl)pyrrolidin-2-one
Related Synonyms
(S)-(-)-Cotinine
(S)-1-Methyl-5-(3-pyridinyl)-2-pyrrolidinone
(S)-Cotinine
cotinina
cotinine
cotininum
class Information
charge

0

formula

C10H12N2O

has_obo_namespace

chebi_ontology

inchi

InChI=1S/C10H12N2O/c1-12-9(4-5-10(12)13)8-3-2-6-11-7-8/h2-3,6-7,9H,4-5H2,1H3/t9-/m0/s1

inchikey

UIKROCXWUNQSPJ-VIFPVBQESA-N

mass

176.21510

monoisotopicmass

176.09496

smiles

[H][C@]1(CCC(=O)N1C)c1cccnc1

class Relations