| Phytochemical Name : Columbamine |
| PCNDIDC0225 |
| Pubchem CID : 72310 |
| Molecular formula: C20H20NO4+ |
| Canonical SMILES : COC1=C(C2=C[N+]3=C(C=C2C=C1)C4=CC(=C(C=C4CC3)OC)O)OC |
Synonymes : Columbamine|3621-36-1|Dehydroisocorypalmine|UNII-7T4808FEJW|3,9,10-trimethoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium-2-ol|7T4808FEJW|CHEMBL400345|Columbamin;Dehydroisocorypalmine|CHEBI:15920|Dibenzo(a,g)quinolizinium, 5,6-dihydro-2-hydroxy-3,9,10-trimethoxy-|2-hydroxy-3,9,10-trimethoxy-5,6-dihydroisoquino[3,2-a]isoquinolinium|5,6-dihydro-2-hydroxy-3,9,10-trimethoxydibenzo[a,g]quinolizinium|Dibenzo[a,g]quinolizinium, 5,6-dihydro-2-hydroxy-3,9,10-trimethoxy-|Columbamin|5,6-DIHYDRO-2-HYDROXY-3,9,10-TRIMETHOXYDIBENZO(A,G)QUINOLIZINIUM|C20H20NO4|COLUMBAMINE [MI]|SCHEMBL422073|DTXSID80189766|HY-N0926|BDBM50226664|AKOS030526792|CS-4254|AC-34218|LS-182873|FT-0723334|C01795|Q27098298|7,8,13,13-alpha-tetradehydro-2-hydroxy-3,9,10-trimethoxyberbinium|Berbinium, 7,8,13,13a-tetradehydro-2-hydroxy-3,9,10-trimethoxy-|3,9,10-trimethoxy-5,6-dihydroisoquinolino[3,2-a]isoquinolin-7-ium-2-ol|5,6-Dihydro-2-hydroxy-3,9,10-trimethoxydibenzo[a,g]quinolizinium iodide|2-Hydroxy-3,9,10-trimethoxy-5,6-dihydroisoquinolino[3,2-a]isoquinolin-7-ium|7,8,13,13.ALPHA.-TETRADEHYDRO-2-HYDROXY-3,9,10-TRIMETHOXYBERBINIUM |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : -0.070 |
| Log Po/w (XLOGP3) : 3.420 |
| Log Po/w (WLOGP) : 3.080 |
| Log Po/w (MLOGP) : 1.780 |
| Log Po/w (SILICOS-IT) : 3.430 |
| Consensus Log Po/w : 2.330 |