Nicotine-N--Glucuronide, Methyl-D3
[CAS# 329002-74-6]

Identification

• Name: Nicotine-N--Glucuronide, Methyl-D3
• Synonyms: 1-Β-D-Glucopyranuronosyl-3-[(2S)-1-(Methyl-D3)-2-Pyrrolidinyl]Pyridinium Inner Salt; (S)-1-Β-D-Glucopyranuronosyl-3-[1-(Methyl-D3)-2-Pyrrolidinyl]Pyridinium Inner Salt; Nicotine-N-B-D-Glucuronide Methyl-D3
• Molecular Formula: C₁₇H₂₂D₃N₂O₇
• Molecular Weight: 372.41
• CAS Registry Number: 329002-74-6
• SMILES: OC(=O)[C@H]1OC(O[N]2(CCCC2c2cccnc2)CC([2H])([2H])[2H])[C@@H]([C@H]([C@@H]1O)O)O
• InChI: 1S/C17H25N2O7/c1-2-19(8-4-6-11(19)10-5-3-7-18-9-10)26-17-14(22)12(20)13(21)15(25-17)16(23)24/h3,5,7,9,11-15,17,20-22H,2,4,6,8H2,1H3,(H,23,24)/t11?,12-,13-,14+,15-,17?/m0/s1/i1D3