Products 1260619-61-1

CAS 1260619-61-1 appears in our catalog under these names: Acetaminophen-d3 Glucuronide Sodium Salt, 4-Acetamidophenyl beta-D-Glucuronide-d3 Sodium Salt, >95% (HPLC), 4–Acetamidophenyl β–D–Glucuronide–d3 Sodium Salt, Acetaminophen glucuronide-d3 (sodium salt), 97.78%. Offered by: Chemat Brand, TRC, GLPBio, MedChemExpress. Available pack sizes: on request, 2,5mg, 25mg, 50mg, 2.5 mg.

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

Sodium (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[4-[(2,2,2-trideuterioacetyl)amino]phenoxy]oxane-2-carboxylate (CAS 1260619-61-1) is a chemical compound with the molecular formula C14H16NNaO8 and a molecular weight of 352.29 g/mol. IUPAC name: sodium (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[4-[(2,2,2-trideuterioacetyl)amino]phenoxy]oxane-2-carboxylate. InChIKey: OINXIJJEOMGKPB-OSQJLVBPSA-M.

Identity
Molecular formulaC14H16NNaO8
Molecular weight352.29 g/mol
IUPAC namesodium (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[4-[(2,2,2-trideuterioacetyl)amino]phenoxy]oxane-2-carboxylate
InChIKeyOINXIJJEOMGKPB-OSQJLVBPSA-M
SMILES[2H]C([2H])([2H])C(=O)NC1=CC=C(C=C1)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C(=O)[O-])O)O)O.[Na+]

Computed by PubChem (NCBI)