Products 3688-65-1

CAS 3688-65-1 appears in our catalog under these names: Codeine N-Oxide, >95% (HPLC), Codeine N-Oxide, CODEINE N-OXIDE, UNITED STATES PHARMACOP. Offered by: TRC, Mikromol, LoGiCal, Sigma-Aldrich. Available pack sizes: 2,5mg, 25mg, 250mg, 10mg, 30MG.

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

(4R,4aR,7S,7aR,12bS)-9-methoxy-3-methyl-3-oxido-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-3-ium-7-ol (CAS 3688-65-1) is a chemical compound with the molecular formula C18H21NO4 and a molecular weight of 315.4 g/mol. IUPAC name: (4R,4aR,7S,7aR,12bS)-9-methoxy-3-methyl-3-oxido-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-3-ium-7-ol. InChIKey: BDLSDHWCOJPHIE-YMVRPXFZSA-N.

Identity
Molecular formulaC18H21NO4
Molecular weight315.4 g/mol
IUPAC name(4R,4aR,7S,7aR,12bS)-9-methoxy-3-methyl-3-oxido-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-3-ium-7-ol
InChIKeyBDLSDHWCOJPHIE-YMVRPXFZSA-N
SMILESC[N+]1(CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@H]3[C@H](C=C4)O)[O-]

Computed by PubChem (NCBI)