Pseudocodeine structure

Pseudocodeine

(4R,4aR,5S,7aS,12bS)-9-methoxy-3-methyl-2,4,4a,5,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-5-ol

Also Known As: Pseudocodeine|Neoisocodeine|psi-Codeine|.OMEGA.-CODEINE|OMEGA-CODEINE|PSEUDOCODEINE [MI]|EINECS 207-380-9|(5alpha,8beta)-6,7-Didehydro-4,5-epoxy-3-methoxy-17-methylmorphinan-8-ol|Morphinan-8-beta-ol, 6,7-didehydro-4,5-alpha-epoxy-3-methoxy-17-methyl-|3-Methoxy-17-methyl-6,7-didehydro-4,5-epoxymorphinan-8-ol|(5.ALPHA.,8.BETA.)-6,7-DIDEHYDRO-4,5-EPOXY-3-METHOXY-17-METHYLMORPHINAN-8-OL|6,7-Didehydro-4,5alpha-epoxy-3-methoxy-17-methylmorphinan-8beta-ol|Morphinan-8-ol, 6,7-didehydro-4,5-epoxy-3-methoxy-17-methyl-, (5.alpha.,8.beta.)-|3-Methoxy-17-methyl-5alpha-6,7-didehydro-4,5-epoxymorphinan-8beta-ol|(5-alpha,8-beta)-6,7-Didehydro-4,5-epoxy-3-methoxy-17-methylmorphinan-8-ol|Morphinan-8-.beta.-ol, 6,7-didehydro-4,5-.alpha.-epoxy-3-methoxy-17-methyl-|Morphinan-8-ol, 6,7-didehydro-4,5-epoxy-3-methoxy-17-methyl-, (5alpha,8beta)-|(1S,5R,13S,16S,17R)-10-methoxy-4-methyl-12-oxa-4-azapentacyclo[9.6.1.01,13.05,17.07,18]octadeca-7,9,11(18),14-tetraen-16-ol|Pseudocodeine; Neoisocodeine; psi-Codeine; (5alpha,8beta)-6,7-didehydro-4,5-epoxy-3-methoxy-17-methylmorphinan-8-ol; psi-Codeine

CAS: 466-96-6
Molecular Formula C18H21NO3
Molecular Weight 299.15213 g/mol
LogP 1.5011
Topological Polar Surface Area 41.93 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 4
Rotatable Bonds 1
Exact Mass 299.15213
Monoisotopic Mass 299.15213
Heavy Atoms 22
Complexity 685.15497

Chemical Identifiers

CAS Number 466-96-6
SMILES CN1CC[C@]23[C@@H]4C=C[C@@H]([C@H]2[C@H]1CC5=C3C(=C(C=C5)OC)O4)O

Product Overview

Pseudocodeine (CAS 466-96-6), with molecular formula C18H21NO3 and molecular weight 299.15213 g/mol. IUPAC: (4R,4aR,5S,7aS,12bS)-9-methoxy-3-methyl-2,4,4a,5,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-5-ol.

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