Products 136765-44-1

CAS 136765-44-1 appears in our catalog under these names: Morphine-3-Beta-D-glucuronide-D3, 0.1mg/ml in Methanol/Water : 1/1, Morphine-3-Beta-D-glucuronide-D3, 1mg/ml in Methanol/Water : 1/1, Morphine-d3 3-Beta-D-Glucuronide, >95% (HPLC), Morphine-d3 3-beta-D-Glucuronide (1mg/ml in Acetonitrile), Morphine-3-Beta-D-glucuronide-D3. Offered by: Lipomed, TRC, Biosynth. Available pack sizes: 1ml, 10mg, 1mg, 1x1ml, 50mg, 100mg, 2mg, 5mg.

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

(2S,3S,4S,5R,6S)-6-[[(4R,4aR,7S,7aR,12bS)-7-hydroxy-3-(trideuteriomethyl)-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-9-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid (CAS 136765-44-1) is a chemical compound with the molecular formula C23H27NO9 and a molecular weight of 464.5 g/mol. IUPAC name: (2S,3S,4S,5R,6S)-6-[[(4R,4aR,7S,7aR,12bS)-7-hydroxy-3-(trideuteriomethyl)-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-9-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid. InChIKey: WAEXKFONHRHFBZ-RHFLYEDMSA-N.

Identity
Molecular formulaC23H27NO9
Molecular weight464.5 g/mol
IUPAC name(2S,3S,4S,5R,6S)-6-[[(4R,4aR,7S,7aR,12bS)-7-hydroxy-3-(trideuteriomethyl)-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-9-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
InChIKeyWAEXKFONHRHFBZ-RHFLYEDMSA-N
SMILES[2H]C([2H])([2H])N1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)C(=O)O)O)O)O)O[C@H]3[C@H](C=C4)O

Computed by PubChem (NCBI)