| Phytochemical Name : (3R,3aR,6S)-3-(furan-3-yl)-6-hydroxy-3a,7-dimethyl-3,4,5,6-tetrahydro-2-benzofuran-1-one |
| PCNDIDOT0160 |
| Pubchem CID : 478833 |
| Molecular formula: C14H16O4 |
| Canonical SMILES : CC1=C2C(=O)OC(C2(CCC1O)C)C3=COC=C3 |
Synonymes : Dasycarpol|202343-57-5|(3R,3aR,6S)-3-(furan-3-yl)-6-hydroxy-3a,7-dimethyl-3,4,5,6-tetrahydro-2-benzofuran-1-one|6?-Hydroxyfraxinellone|9beta-hydroxyfraxinellone|6beta-Hydroxyfraxinellone|CHEMBL257169|MEGxp0_000826|AKOS032962702 |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.080 |
| Log Po/w (XLOGP3) : 1.170 |
| Log Po/w (WLOGP) : 2.030 |
| Log Po/w (MLOGP) : 1.230 |
| Log Po/w (SILICOS-IT) : 2.400 |
| Consensus Log Po/w : 1.780 |