| Phytochemical Name : Neolinderalactone |
| PCNDIDN0037 |
| Pubchem CID : 12311262 |
| Molecular formula: C15H16O3 |
| Canonical SMILES : CC1=CCCC2=CC(C3=C(C1)OC=C3C)OC2=O |
Synonymes : Neolinderalactone|(1R,8Z)-3,8-Dimethyl-5,14-dioxatricyclo[10.2.1.02,6]pentadeca-2(6),3,8,12(15)-tetraen-13-one|(R,10E)-4,8,9,12-Tetrahydro-3,11-dimethyl-6H-4,7-methenofuro[3,2-c]oxacycloundecin-6-one|26379-18-0 |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.520 |
| Log Po/w (XLOGP3) : 2.680 |
| Log Po/w (WLOGP) : 3.070 |
| Log Po/w (MLOGP) : 2.250 |
| Log Po/w (SILICOS-IT) : 3.340 |
| Consensus Log Po/w : 2.770 |