Products 329002-74-6

CAS 329002-74-6 appears in our catalog under these names: (S)-Nicotine-d3 N-Beta-D-Glucuronide, >95% (HPLC), Nicotine N–β–D–glucuronide–d3, Nicotine N-β-D-glucuronide-d3, (R)-Nicotine-d3 N-β-D-Glucuronide. Offered by: TRC, GLPBio, MedChemExpress. Available pack sizes: 10mg, 1mg, 2,5mg, 1 mg, Get quote.

Structural formula: {0} (CAS {1})

(2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[3-[(2S)-1-(trideuteriomethyl)pyrrolidin-2-yl]pyridin-1-ium-1-yl]oxane-2-carboxylate (CAS 329002-74-6) is a chemical compound with the molecular formula C16H22N2O6 and a molecular weight of 341.37 g/mol. IUPAC name: (2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[3-[(2S)-1-(trideuteriomethyl)pyrrolidin-2-yl]pyridin-1-ium-1-yl]oxane-2-carboxylate. InChIKey: SAWAIULJDYFLPD-QPGHRLPYSA-N.

Identity
Molecular formulaC16H22N2O6
Molecular weight341.37 g/mol
IUPAC name(2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[3-[(2S)-1-(trideuteriomethyl)pyrrolidin-2-yl]pyridin-1-ium-1-yl]oxane-2-carboxylate
InChIKeySAWAIULJDYFLPD-QPGHRLPYSA-N
SMILES[2H]C([2H])([2H])N1CCC[C@H]1C2=C[N+](=CC=C2)[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)C(=O)[O-])O)O)O

Computed by PubChem (NCBI)