| Phytochemical Name : alpha-Bergamotenol |
| PCNDIDA0079 |
| Pubchem CID : 5368743 |
| Molecular formula: C15H24O |
| Canonical SMILES : CC1=CCC2CC1C2(C)CCC=C(C)CO |
Synonymes : alpha-Bergamotenol|Bergamotenol|88034-74-6|(Z)-5-(2,6-dimethyl-6-bicyclo[3.1.1]hept-2-enyl)-2-methylpent-2-en-1-ol|2-Penten-1-ol, 5-(2,6-dimethylbicycylo(3.1.1)hept-2-en-6-yl)-2-methyl-, (1S-(1alpha,5alpha,6alpha(Z)))-|Bergamotol, Z-.alpha.-trans-|(z,e)- alpha-bergamotol|.alpha.-trans-Bergamotenol|Trans-(z)-alpha-bergamotol|(z)-trans- alpha-bergamotol|(Z,E)- .alpha.-Bergamotol|(Z)-.alpha.-trans-Bergamotol|(Z)-trans- .alpha.-Bergamotol|SCHEMBL17123412|9(10)Z,alpha-trans-Bergamotenol|(2Z)-5-{2,6-dimethylbicyclo[3.1.1]hept-2-en-6-yl}-2-methylpent-2-en-1-ol|5-(2,6-Dimethylbicyclo[3.1.1]hept-2-en-6-yl)-2-methyl-2-penten-1-ol-, [1S-[1a,5a,6a(Z)]]- |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.980 |
| Log Po/w (XLOGP3) : 5.200 |
| Log Po/w (WLOGP) : 3.700 |
| Log Po/w (MLOGP) : 3.560 |
| Log Po/w (SILICOS-IT) : 3.660 |
| Consensus Log Po/w : 3.820 |