Nicotine N-Beta-D-Glucuronide

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For Research Use Only | Not For Clinical Use
CATAPS153536539
CAS153536-53-9
Structure
SynonymsPyridinium, 1-β-D-glucopyranuronosyl-3-[(2S)-1-methyl-2-pyrrolidinyl]-, inner salt, Nicotine N-glucuronide, Nicotine N-β-D-Glucuronide, Pyridinium, 1-β-D-glucopyranuronosyl-3-(1-methyl-2-pyrrolidinyl)-, inner salt, (S)-
IUPAC Name(2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[3-[(2S)-1-methylpyrrolidin-2-yl]pyridin-1-ium-1-yl]oxane-2-carboxylate
Molecular Weight338.36
Molecular FormulaC16H22N2O6
Canonical SMILESCN1CCC[C@H]1c2ccc[n+](c2)[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C(=O)[O-]
InChIInChI=1S/C16H22N2O6/c1-17-6-3-5-10(17)9-4-2-7-18(8-9)15-13(21)11(19)12(20)14(24-15)16(22)23/h2,4,7-8,10-15,19-21H,3,5-6H2,1H3/t10-,11-,12-,13+,14-,15+/m0/s1
Accurate Mass338.1478
FormatNeat
  • Verification code
CATSizeShippingStorage ConditionsDescription
APS153536539-10MG 10MG Room Temperature -20°C Freezer Subcategory: Chiral molecules Inquiry
APS153536539-1MG 1MG Room Temperature -20°C Freezer Subcategory: Chiral molecules, Pharmaceutical, Nicotine and related compounds; Product Type: Metabolite Inquiry
APS153536539-5MG 5MG Room Temperature -20°C Freezer Subcategory: Chiral molecules Inquiry
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