| Phytochemical Name : Bicyclo[6.3.0]undeca-1,7-dien-3-one, 5,5-dimethyl- |
| PCNDIDB0105 |
| Pubchem CID : 5372011 |
| Molecular formula: C13H18O |
| Canonical SMILES : CC1(CC=C2CCCC2=CC(=O)C1)C |
Synonymes : Bicyclo[6.3.0]undeca-1,7-dien-3-one, 5,5-dimethyl-|7,7-Dimethyl-1,2,3,6,7,8-hexahydro-5H-cyclopenta[a]cycloocten-5-one # |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.540 |
| Log Po/w (XLOGP3) : 2.450 |
| Log Po/w (WLOGP) : 3.410 |
| Log Po/w (MLOGP) : 2.940 |
| Log Po/w (SILICOS-IT) : 3.440 |
| Consensus Log Po/w : 2.960 |