| Phytochemical Name : Inophyllum E |
| PCNDIDI0022 |
| Pubchem CID : 5254 |
| Molecular formula: C25H22O5 |
| Canonical SMILES : CC1C(OC2=C(C1=O)C3=C(C(=CC(=O)O3)C4=CC=CC=C4)C5=C2C=CC(O5)(C)C)C |
Synonymes : cis-and-trans-Inophyllolide|Inophyllum E|MEGxp0_000925|ACon1_000956|CHEBI:188173|LMPK12100023|NCGC00169193-01|BRD-A91277205-001-01-2|10,10,16,17-tetramethyl-6-phenyl-3,9,15-trioxatetracyclo[12.4.0.02,7.08,13]octadeca-1(14),2(7),5,8(13),11-pentaene-4,18-dione |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 3.430 |
| Log Po/w (XLOGP3) : 4.470 |
| Log Po/w (WLOGP) : 5.140 |
| Log Po/w (MLOGP) : 3.180 |
| Log Po/w (SILICOS-IT) : 5.490 |
| Consensus Log Po/w : 4.340 |