| Phytochemical Name : 2H-Pyran-2-one, 6-[2-(acetyloxy)-4-phenyl-3-butenyl]-5,6-dihydro- |
| PCNDIDOT0593 |
| Pubchem CID : 5373608 |
| Molecular formula: C17H18O4 |
| Canonical SMILES : CC(=O)OC(CC1CC=CC(=O)O1)C=CC2=CC=CC=C2 |
Synonymes : Cryptocaryalactone|2H-Pyran-2-one, 6-[2-(acetyloxy)-4-phenyl-3-butenyl]-5,6-dihydro-|2H-Pyran-2-one, 5,6-dihydro-6-(2-hydroxy-4-phenyl-3-butenyl)-, acetate, (E)-|(2E)-1-[(6-Oxo-3,6-dihydro-2H-pyran-2-yl)methyl]-3-phenyl-2-propenyl acetate #|2H-Pyran-2-one, 6-[2-(acetyloxy)-4-phenyl-3-butenyl]-5,6-dihydro-, (E)- |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.470 |
| Log Po/w (XLOGP3) : 3.170 |
| Log Po/w (WLOGP) : 2.780 |
| Log Po/w (MLOGP) : 2.580 |
| Log Po/w (SILICOS-IT) : 3.190 |
| Consensus Log Po/w : 2.840 |