| Phytochemical Name : Erysodine |
| PCNDIDE0054 |
| Pubchem CID : 169017 |
| Molecular formula: C18H21NO3 |
| Canonical SMILES : COC1CC23C(=CCN2CCC4=CC(=C(C=C34)OC)O)C=C1 |
Synonymes : Erysodine|Erysodin|(+)-erysodine|7290-03-1|6WZ3T41Y11|(2R,13bS)-2,12-dimethoxy-2,6,8,9-tetrahydro-1H-indolo[7a,1-a]isoquinolin-11-ol|1,2,6,7-Tetradehydro-3,15-dimethoxyerythrinan-16-ol|UNII-6WZ3T41Y11|CHEMBL446533|Erythrinan-16-ol, 1,2,6,7-tetradehydro-3,15-dimethoxy-, (3.beta.)-|DTXSID20993682|CHEBI:192381|BDBM50006647|Q27265641|3,15-Dimethoxy-1,2,6,7-tetradehydroerythrinan-16-ol|1,2,6,7-tetradehydro-3beta,15-dimethoxyerythrinan-16-ol|3beta,15-dimethoxy-1,2,6,7-tetradehydroerythrinan-16-ol|(3beta)-1,2,6,7-tetradehydro-3,15-dimethoxyerythrinan-16-ol|1,2,6,7-Tetradehydro-3,15-dimethoxy-(3beta)-Erythrinan-16-ol|Erythrinan-16-ol, 1,2,6,7-tetradehydro-3,15-dimethoxy-, (3beta)-|(12R,13aS)-2,12-dimethoxy-5H,6H,8H,12H,13H-indolo[7a,1-a]isoquinolin-3-ol |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.930 |
| Log Po/w (XLOGP3) : 1.820 |
| Log Po/w (WLOGP) : 1.880 |
| Log Po/w (MLOGP) : 1.890 |
| Log Po/w (SILICOS-IT) : 2.170 |
| Consensus Log Po/w : 2.140 |