Products 5913-76-8

CAS 5913-76-8 is the registry number for Codeine phosphate sesquihydrate. Offered by: Biosynth. Available pack sizes: 5000mg.

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

Bis((4R,4aR,7S,7aR,12bS)-9-methoxy-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-ol);phosphoric acid;trihydrate (CAS 5913-76-8) is a chemical compound with the molecular formula C36H54N2O17P2 and a molecular weight of 848.8 g/mol. IUPAC name: bis((4R,4aR,7S,7aR,12bS)-9-methoxy-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-ol);phosphoric acid;trihydrate. InChIKey: UDIMULCGRYVAIM-REWFBLHLSA-N.

Identity
Molecular formulaC36H54N2O17P2
Molecular weight848.8 g/mol
IUPAC namebis((4R,4aR,7S,7aR,12bS)-9-methoxy-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-ol);phosphoric acid;trihydrate
InChIKeyUDIMULCGRYVAIM-REWFBLHLSA-N
SMILESCN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@H]3[C@H](C=C4)O.CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@H]3[C@H](C=C4)O.O.O.O.OP(=O)(O)O.OP(=O)(O)O

Computed by PubChem (NCBI)