| Phytochemical Name : beta-COLUBRINE |
| PCNDIDB0071 |
| Pubchem CID : 251890 |
| Molecular formula: C22H24N2O3 |
| Canonical SMILES : COC1=CC2=C(C=C1)N3C4C25CCN6C5CC7C4C(CC3=O)OCC=C7C6 |
Synonymes : beta-COLUBRINE|2-Methoxystrychnidin-10-one|COLUBRINE, BETA|Strychnine, 2-methoxy-|2-Methoxy strychnine|509-36-4|.beta.-Colubrine|2-Methoxystrychnine|2-Methoxy-strychnine|Strychnidin-10-one, 2-methoxy-|PEK2HDB6QQ|UNII-PEK2HDB6QQ|NSC72862|NSC 72862|NSC-72862|(4aR,5aS,8aR,13aS,15aS,15bR)-10-methoxy-4a,5,5a,7,8,13a,15,15a,15b,16-decahydro-2H-4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinolin-14-one|MLS002693787|ss-Colubrin|10-METHOXYSTRYCHNINE|.BETA.-COLUBRINE [MI]|CHEMBL1994566|CHEBI:132697|DTXSID301031421|NCI60_041585|Q27286513 |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.990 |
| Log Po/w (XLOGP3) : 1.850 |
| Log Po/w (WLOGP) : 1.340 |
| Log Po/w (MLOGP) : 2.370 |
| Log Po/w (SILICOS-IT) : 1.800 |
| Consensus Log Po/w : 2.070 |