| Phytochemical Name : Carotol |
| PCNDIDC0056 |
| Pubchem CID : 442347 |
| Molecular formula: C15H26O |
| Canonical SMILES : CC1=CCC2(CCC(C2(CC1)O)C(C)C)C |
Synonymes : Carotol|465-28-1|(+)-Carotol|UNII-NT5C9M36DE|(+)-8-Daucen-5-ol|NT5C9M36DE|Carotol, (+)-|3aalpha(1H)-Azulenol, 2,3,4,5,8,8a-hexahydro-3alpha-isopropyl-6,8aalpha-dimethyl-, (+)-|CAROTOL [MI]|CHEBI:3431|SCHEMBL6514107|2,3,4,5,8,8a-hexahydro-3-isopropyl-6,8a-dimethyl-3a(1h)-azulenol|(3R,3aS,8aR)-2,3,4,5,8,8a-Hexa-hydro-6,8a-dimethyl-3-(1-methylethyl)-3a(1H)-azulenol|DTXSID101318114|LMPR0103550001|(3R,3aS,8aR)-6,8a-dimethyl-3-propan-2-yl-1,2,3,4,5,8-hexahydroazulen-3a-ol|C09628|Q5045553|(3R,3AS,8AR)-2,3,4,5,8,8A-HEXAHYDRO-6,8A-DIMETHYL-3-(1-METHYLETHYL)-3A(1H)-AZULENOL|3A(1H)-AZULENOL, 2,3,4,5,8,8A-HEXAHYDRO-6,8A-DIMETHYL-3-(1-METHYLETHYL)-, (3R,3AS,8AR)-|3a(1H)-Azulenol, 2,3,4,5,8,8a-hexahydro-6,8a-dimethyl-3-(1-methylethyl)-, (3R-(3alpha,3aalpha,8aalpha))- |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 3.190 |
| Log Po/w (XLOGP3) : 3.580 |
| Log Po/w (WLOGP) : 3.920 |
| Log Po/w (MLOGP) : 3.670 |
| Log Po/w (SILICOS-IT) : 3.620 |
| Consensus Log Po/w : 3.600 |