| Phytochemical Name : Arnebinol |
| PCNDIDA0185 |
| Pubchem CID : 5281558 |
| Molecular formula: C16H20O2 |
| Canonical SMILES : CC1=CCC2=C(C=CC(=C2)OCC(=CCC1)C)O |
Synonymes : Arnebinol|C09917|(4E,8E)-4,8-DIMETHYL-2-OXABICYCLO[9.3.1]PENTADECA-1(15),4,8,11,13-PENTAEN-12-OL|AC1NQYMJ|CHEBI:2827|DTXSID201136727|(3E,7E)-4,8-dimethyl-10-oxabicyclo[9.3.1]pentadeca-1(14),3,7,11(15),12-pentaen-14-ol|Q27105840 |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.710 |
| Log Po/w (XLOGP3) : 3.410 |
| Log Po/w (WLOGP) : 4.000 |
| Log Po/w (MLOGP) : 3.140 |
| Log Po/w (SILICOS-IT) : 3.530 |
| Consensus Log Po/w : 3.360 |