| Phytochemical Name : 4-[(2S)-2,3-dihydroxy-3-methylbutoxy]furo[3,2-g]chromen-7-one |
| PCNDIDOT0824 |
| Pubchem CID : 899657 |
| Molecular formula: C16H16O6 |
| Canonical SMILES : CC(C)(C(COC1=C2C=CC(=O)OC2=CC3=C1C=CO3)O)O |
Synonymes : 133164-11-1|Oxypeucedanin hydrate|(-)-Oxypeucedanin hydrate|4-[(2S)-2,3-dihydroxy-3-methylbutoxy]furo[3,2-g]chromen-7-one|(?)-Oxypeucedanin hydrate|HY-N2254|AC-34774|MS-24391|CS-0019583|4-[(2S)-2,3-dihydroxy-3-methyl-butoxy]furo[3,2-g]chromen-7-one|5-(2,3-Dihydroxy-3-methylbutoxy)-7H-furo[3,2-g]chromen-7-one|7H-Furo[3,2-g][1]benzopyran-7-one, 4-[(2S)-2,3-dihydroxy-3-methylbutoxy]- |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.460 |
| Log Po/w (XLOGP3) : 1.250 |
| Log Po/w (WLOGP) : 2.050 |
| Log Po/w (MLOGP) : 0.570 |
| Log Po/w (SILICOS-IT) : 2.610 |
| Consensus Log Po/w : 1.790 |