Terminology Service for NFDI4Health
(S)-nicotine N(1')-oxide
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http://purl.obolibrary.org/obo/CHEBI_142659
A nicotine N(1')-oxide resulting from the oxidation of the pyrrolidine nitrogen of (S)-nicotine; major species at pH 7.3.
Term info
Label
(S)-nicotine N(1')-oxide
Synonyms
- (S)-nicotine N(1')-oxide
- 3-[(2S)-1-methyl-1-oxidopyrrolidin-2-yl]pyridine
Subsets
3_STAR
charge
0
formula
C10H14N2O
has obo namespace
chebi_ontology
has related synonym
nicotine N'-oxide, N-oxynicotine, oxynicotine, nicotine-N'-oxide, nicotine 1'-N-oxide, NOX, nicotine-1'-N-oxide
id
CHEBI:142659
inchi
InChI=1S/C10H14N2O/c1-12(13)7-3-5-10(12)9-4-2-6-11-8-9/h2,4,6,8,10H,3,5,7H2,1H3/t10-,12?/m0/s1
inchikey
RWFBQHICRCUQJJ-NUHJPDEHSA-N
mass
178.231
monoisotopicmass
178.11061
smiles
C1=CC([C@]2([N+](CCC2)([O-])C)[H])=CN=C1