Nicodicodine
[(4R,4aR,7S,7aR,12bS)-9-methoxy-3-methyl-2,4,4a,5,6,7,7a,13-octahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-yl] pyridine-3-carboxylate
Also Known As: Nicodicodine|Nicodicodina|Nicodicodinum|Nicodicodin|Nicodicodina [DCIT]|6-Nicotinoyl dihydrocodeine|Nicodicodinum [INN-Latin]|NICODICODINE [INN]|Dihydrocodeine 6-nicotinate|Codeine, dihydro-, nicotinate|Nicodicodine [INN:BAN:DCF]|Dihydrocodein-nicotinat (ester)|Nicodicodinum (INN-Latin)|IDS-NN-002(SECT.2)|EINECS 212-365-5|Nicodicodine [BAN:DCF:INN]|Codeine, dihydro-, nicotinate (ester)|4,5alpha-Epoxy-3-methoxy-17-methyl-6alpha-morphinanylnicotinat|Nicotinsaeure-(4,5-epoxy-3-methoxy-17-methyl-morphinan-6-yl)-ester|Morphinan-6.alpha.-ol, 4,5.alpha.-epoxy-3-methoxy-17-methyl-, nicotinate (ester)|4,5alpha-Epoxy-3-methoxy-17-methylmorphinan-6alpha-ol 3-pyridinecarboxylate|Morphinan-6-ol, 4,5-epoxy-3-methoxy-17-methyl-, 3-pyridinecarboxylate (ester), (5.alpha.,6.alpha.)-|MORPHINAN-6-OL, 4,5-EPOXY-3-METHOXY-17-METHYL-, 9-(3-PYRIDINECARBOXYLATE), (5.ALPHA.,6.ALPHA.)-|3-Methoxy-17-methyl-5alpha-4,5-epoxymorphinan-6alpha-yl pyridine-3-carboxylate|Morphinan-6-ol, 4,5-epoxy-3-methoxy-17-methyl-, 3-pyridinecarboxylate, (5alpha,6alpha)-|Morphinan-6alpha-ol, 4,5alpha-epoxy-3-methoxy-17-methyl-, nicotinate (ester)|(1S,5R,13R,14S,17R)-10-methoxy-4-methyl-12-oxa-4-azapentacyclo[9.6.1.01,13.05,17.07,18]octadeca-7,9,11(18)-trien-14-yl pyridine-3-carboxylate|212-365-5|Morphinan-6-ol, 4,5-epoxy-3-methoxy-17-methyl-, 3-pyridinecarboxylate (ester), (5alpha,6alpha)-|Morphinan-6-ol, 4,5-epoxy-3-methoxy-17-methyl-, 3-pyridinecarboxylate, (5.alpha.,6.alpha.)-|MORPHINAN-6-OL, 4,5-EPOXY-3-METHOXY-17-METHYL-, 9-(3-PYRIDINECARBOXYLATE), (5ALPHA,6ALPHA)-|Nicodicodine; Morphinan-6-ol, 4,5-epoxy-3-methoxy-17-methyl-, 9-(3-pyridinecarboxylate), (5a,6a)-; Codeine, dihydro-, nicotinate (6CI,7CI); Morphinan-6-ol, 4,5-epoxy-3-methoxy-17-methyl-, 3-pyridinecarboxylate (ester), (5a,6a)- (9CI); Morphinan-6a-ol, 4,5a-epoxy-3-meth
| Molecular Formula | C24H26N2O4 |
|---|---|
| Molecular Weight | 406.18927 g/mol |
| LogP | 2.9848 |
| Topological Polar Surface Area | 60.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 406.18927 |
| Monoisotopic Mass | 406.18927 |
| Heavy Atoms | 30 |
| Complexity | 1009.76556 |
Chemical Identifiers
| CAS Number | 808-24-2 |
|---|---|
| SMILES | CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@H]3[C@H](CC4)OC(=O)C6=CN=CC=C6 |
Product Overview
Nicodicodine (CAS 808-24-2), with molecular formula C24H26N2O4 and molecular weight 406.18927 g/mol. IUPAC: [(4R,4aR,7S,7aR,12bS)-9-methoxy-3-methyl-2,4,4a,5,6,7,7a,13-octahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-yl] pyridine-3-carboxylate.