14-Hydroxycodeinone propionate
[(4R,4aS,7aR,12bS)-9-methoxy-3-methyl-7-oxo-2,4,7a,13-tetrahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-4a-yl] propanoate
Also Known As: 14-Hydroxycodeinone propionate|Codeinone, 14-hydroxy-, propionate|Morphinan-6-one, 7,8-didehydro-4,5-epoxy-3-methoxy-17-methyl-14-(1-oxopropoxy)-, (5-alpha)-|Morphinan-6-one, 7,8-didehydro-4,5-alpha-epoxy-14-hydroxy-3-methoxy-17-methyl-, propionate (ester)|Morphinan-6-one, 7,8-didehydro-4,5-epoxy-3-methoxy-17-methyl-14-(1-oxopropoxy)-, (5alpha)-|Morphinan-6-one, 7,8-didehydro-4,5-epoxy-3- methoxy-17-methyl-14-(1-oxopropoxy)-, (5?)-|3-Methoxy-17-methyl-6-oxo-5alpha-7,8-didehydro-4,5-epoxymorphinan-14-yl propanoate
| Molecular Formula | C21H23NO5 |
|---|---|
| Molecular Weight | 369.15762 g/mol |
| LogP | 1.7851 |
| Topological Polar Surface Area | 65.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 369.15762 |
| Monoisotopic Mass | 369.15762 |
| Heavy Atoms | 27 |
| Complexity | 892.80334 |
Chemical Identifiers
| CAS Number | 981-01-1 |
|---|---|
| SMILES | CCC(=O)O[C@@]12C=CC(=O)[C@H]3[C@@]14CCN([C@@H]2CC5=C4C(=C(C=C5)OC)O3)C |
Product Overview
14-Hydroxycodeinone propionate (CAS 981-01-1), with molecular formula C21H23NO5 and molecular weight 369.15762 g/mol. IUPAC: [(4R,4aS,7aR,12bS)-9-methoxy-3-methyl-7-oxo-2,4,7a,13-tetrahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-4a-yl] propanoate.
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