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CHEBI:142660 - trans-(S)-nicotine N1'-oxide

ChEBI IDCHEBI:142660
ChEBI Nametrans-(S)-nicotine N1'-oxide
Stars
ASCII Nametrans-(S)-nicotine N(1')-oxide
DefinitionAn (S)-nicotine N1'-oxide in which the N1'-methyl group is on the opposite side of the pyrrolidine ring to the pyridine substituent. The major species at pH 7.3.
Last Modified21 January 2019
SubmitterAnne Morgat
DownloadsMolfile
FormulaC10H14N2O
Net Charge0
Average Mass178.235
Monoisotopic Mass178.11061
SMILES[H][C@@]1(c2cccnc2)CCC[N@+]1(C)[O-]
InChIInChI=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
InChIKeyRWFBQHICRCUQJJ-JQWIXIFHSA-N
ChEBI Ontology
Outgoing Relation(s)
trans-(S)-nicotine N1'-oxide (CHEBI:142660) is a (S)-nicotine N1'-oxide (CHEBI:142659)
IUPAC Name 
3-[(1S,2S)-1-methyl-1-oxidopyrrolidin-2-yl]pyridine
Synonyms  Source
trans-NOXSUBMITTER
trans-(S)-(−)-nicotine N1'-oxideChEBI
UniProt Name  Source
trans-(S)-nicotine N1'-oxideUniProt
Citations