| Phytochemical Name : Coriandrone A |
| PCNDIDC0242 |
| Pubchem CID : 131752231 |
| Molecular formula: C16H20O5 |
| Canonical SMILES : CC1CC2=CC(=C3CC(OC3=C2C(=O)O1)C(C)(C)O)OC |
Synonymes : Coriandrone A|2-(2-hydroxypropan-2-yl)-4-methoxy-7-methyl-2,3,6,7-tetrahydrofuro[3,2-h]isochromen-9-one|139906-03-9|CHEBI:174777|AKOS040735885|2-(2-hydroxypropan-2-yl)-4-methoxy-7-methyl-2,3,6,7-tetrahydrouro[3,2-h]isochromen-9-one |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.550 |
| Log Po/w (XLOGP3) : 2.220 |
| Log Po/w (WLOGP) : 1.870 |
| Log Po/w (MLOGP) : 1.750 |
| Log Po/w (SILICOS-IT) : 2.860 |
| Consensus Log Po/w : 2.250 |