| Phytochemical Name : Licoagrocarpin |
| PCNDIDL0043 |
| Pubchem CID : 15840593 |
| Molecular formula: C21H22O4 |
| Canonical SMILES : CC(=CCC1=C(C=CC2=C1OCC3C2OC4=C3C=CC(=C4)OC)O)C |
Synonymes : LICOAGROCARPIN|CHEMBL2437361|CHEBI:174544|DTXSID801114339|(6aR,11aR)-6a,11a-Dihydro-9-methoxy-4-(3-methyl-2-buten-1-yl)-6H-benzofuro[3,2-c][1]benzopyran-3-ol|(6aR,11aR)-9-methoxy-4-(3-methylbut-2-enyl)-6a,11a-dihydro-6H-[1]benzouro[3,2-c]chromen-3-ol|202815-29-0 |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 3.660 |
| Log Po/w (XLOGP3) : 4.540 |
| Log Po/w (WLOGP) : 4.190 |
| Log Po/w (MLOGP) : 2.950 |
| Log Po/w (SILICOS-IT) : 4.440 |
| Consensus Log Po/w : 3.960 |