| Phytochemical Name : Xuelianlactone |
| PCNDIDX0012 |
| Pubchem CID : 147111 |
| Molecular formula: C15H20O3 |
| Canonical SMILES : CC1C2C(CC(=C)C3CCC(=C)C3C2OC1=O)O |
Synonymes : Xuelianlactone|107259-46-1|(3R,3aR,4R,6aR,9aR,9bR)-4-hydroxy-3-methyl-6,9-dimethylidene-3a,4,5,6a,7,8,9a,9b-octahydro-3H-azuleno[4,5-b]furan-2-one|Azuleno(4,5-b)furan-2(3H)-one, decahydro-4-hydroxy-3-methyl-6,9-bis(methylene)-, (3R-(3alpha,3abeta,4alpha,6abeta,9abeta,9balpha))-|DTXSID80147982|AKOS040754474 |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.390 |
| Log Po/w (XLOGP3) : 1.750 |
| Log Po/w (WLOGP) : 2.070 |
| Log Po/w (MLOGP) : 2.470 |
| Log Po/w (SILICOS-IT) : 2.230 |
| Consensus Log Po/w : 2.180 |