| Phytochemical Name : Mollislactone |
| PCNDIDM0137 |
| Pubchem CID : 6441988 |
| Molecular formula: C15H20O2 |
| Canonical SMILES : CC=C1C2=CCCC=C(CCCC2OC1=O)C |
Synonymes : Mollislactone|88515-59-7|Cyclodeca(b)furan-2(3H)-one, 3-ethylidene-5,6,9,10,11,11a-hexahydro-8-methyl-|3-Ethylidene-5,6,9,10,11,11a-hexahydro-8-methylcyclodeca(b)furan-2(3H)-one|Cyclodeca[b]furan-2(3H)-one, 3-ethylidene-5,6,9,10,11,11a-hexahydro-8-methyl-|(3Z,3aZ,7Z)-3-ethylidene-8-methyl-5,6,9,10,11,11a-hexahydrocyclodeca[b]furan-2-one |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.750 |
| Log Po/w (XLOGP3) : 2.940 |
| Log Po/w (WLOGP) : 3.690 |
| Log Po/w (MLOGP) : 3.260 |
| Log Po/w (SILICOS-IT) : 3.370 |
| Consensus Log Po/w : 3.200 |