| Phytochemical Name : 1-Methyl-6-methylidene-4-(propan-2-yl)-decahydronaphthalene-1,4a-diol |
| PCNDIDOT0435 |
| Pubchem CID : 12302239 |
| Molecular formula: C15H26O2 |
| Canonical SMILES : CC(C)C1CCC(C2C1(CC(=C)CC2)O)(C)O |
Synonymes : Isocalamenediol|1-methyl-6-methylidene-4-(propan-2-yl)-decahydronaphthalene-1,4a-diol|(1R,8aalpha)-Decahydro-1-methyl-6-methylene-4beta-isopropyl-1alpha,4abeta-naphthalenediol|Cadin-4(14)-ene-6,10-diol|1,4a(2H)-Naphthalenediol, octahydro-1-methyl-6-methylene-4-(1-methylethyl)-, (1R,4S,4aR,8aS)-|1,4a(2H)-Naphthalenediol, octahydro-1-methyl-6-methylene-4-(1-methylethyl)-, [1R-(1.alpha.,4.beta.,4a.beta.,8a.alpha.)]- |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.820 |
| Log Po/w (XLOGP3) : 2.450 |
| Log Po/w (WLOGP) : 2.890 |
| Log Po/w (MLOGP) : 2.740 |
| Log Po/w (SILICOS-IT) : 3.000 |
| Consensus Log Po/w : 2.780 |