| Phytochemical Name : Cyclanoline |
| PCNDIDC0300 |
| Pubchem CID : 3082134 |
| Molecular formula: C20H24NO4+ |
| Canonical SMILES : C[N+]12CCC3=CC(=C(C=C3C1CC4=C(C2)C(=C(C=C4)OC)O)O)OC |
Synonymes : Cyclanoline|Cissamine|18556-27-9|77QC59KBD2|UNII-77QC59KBD2|(7S,13aS)-3,10-dimethoxy-7-methyl-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinolin-7-ium-2,9-diol|6H-Dibenzo(a,g)quinolizinium, 5,8,13,13a-tetrahydro-2,9-dihydroxy-3,10-dimethoxy-7-methyl-, (7S-cis)-|alpha-Cyclanoline|(-)-Cyclanoline|6H-Dibenzo[a,g]quinolizinium, 5,8,13,13a-tetrahydro-2,9-dihydroxy-3,10-dimethoxy-7-methyl-, (7S-cis)-|(-)-Cissamine|(S,S)-N-methylscoulerine|(S)-cis-N-methylscoulerine|CHEBI:76923|DTXSID00171789|Q15410909|(7S,13aS)-2,9-dihydroxy-3,10-dimethoxy-7-methyl-5,8,13,13a-tetrahydro-6H-isoquinolino[3,2-a]isoquinolinium|(7S,13aS)-5,8,13,13a-Tetrahydro-2,9-dihydroxy-3,10-dimethoxy-7-methyl-6H-dibenzo[a,g]quinolizinium|6H-Dibenzo[a,g]quinolizinium, 5,8,13,13a-tetrahydro-2,9-dihydroxy-3,10-dimethoxy-7-methyl-, (7S,13aS)-|6H-Dibenzo[a,g]quinolizinium,5,8,13,13a-tetrahydro-2,9-dihydroxy-3,10-dimethoxy-7-methyl-, (7S,13aS)-|6H-Dibenzo[a,g]quinolizinium,5,8,13,13a-tetrahydro-2,9-dihydroxy-3,10-dimethoxy-7-methyl-,(7s,13as)- |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 0.020 |
| Log Po/w (XLOGP3) : 2.600 |
| Log Po/w (WLOGP) : 2.060 |
| Log Po/w (MLOGP) : -1.710 |
| Log Po/w (SILICOS-IT) : 0.310 |
| Consensus Log Po/w : 0.660 |