Product Code
TRC-N428000
CAS Number
Product Format
Neat
Molecular Formula
C10 H14 N2 O
Molecular Weight
178.23
Product Categories
Product Type
MetabolitePurity
>95% (GC)
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Analyte Name
(2'S)-Nicotine 1-Oxide
CAS Number
2820-55-5
Molecular Formula
C10 H14 N2 O
Molecular Weight
178.23
Accurate Mass
178.1106
SMILES
CN1CCC[C@H]1c2ccc[n+]([O-])c2
InChI
InChI=1S/C10H14N2O/c1-11-6-3-5-10(11)9-4-2-7-12(13)8-9/h2,4,7-8,10H,3,5-6H2,1H3/t10-/m0/s1
IUPAC
3-[(2S)-1-methylpyrrolidin-2-yl]-1-oxidopyridin-1-ium
Storage Temperature
+4°C
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Type
Metabolite
Product Format
Neat
Purity
>95% (GC)
Nicotine-1???-N-oxide is a derivative of Nicotine (N412420) found in the leaves, stems, and roots of N. tabacum, N. affinis and N. sylvestris. Nicotine-1???-N-oxide has also been identified as metabolites of nicotine in animals and in man. The metabolism of nicotine in man proceeds by alternative routes of oxidation of nitrogen to form nicotine-1???-N-oxide (both diastereomers) or cotinine. The ratio of these two products has been suggested as an indicator of bladder cancer in humans.
References: Phillipson, J.D., et al.: Phytochemistry, 14, 2683 (1975); Sindelar, R.D., et al.: Appl. Environ. Microbiol., 38, 836 (1979),
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