| Phytochemical Name : 7-Geranyloxy-6-methoxycoumarin |
| PCNDIDOT1018 |
| Pubchem CID : 5319406 |
| Molecular formula: C20H24O4 |
| Canonical SMILES : CC(=CCCC(=CCOC1=C(C=C2C=CC(=O)OC2=C1)OC)C)C |
Synonymes : 7-Geranyloxy-6-methoxycoumarin|28587-43-1|7-O-Geranylscopoletin|6-Methoxyaurapten|CHEMBL2346913|7-[(2E)-3,7-dimethylocta-2,6-dienoxy]-6-methoxychromen-2-one|(E)-7-((3,7-Dimethyl-2,6-octadienyl)oxy)-6-methoxy-2H-1-benzopyran-2-one|2H-1-Benzopyran-2-one, 7-((3,7-dimethyl-2,6-octadienyl)oxy)-6-methoxy-, (E)-|2H-1-Benzopyran-2-one, 7-[[(2E)-3,7-dimethyl-2,6-octadien-1-yl]oxy]-6-methoxy-|7-O-Geranyl-esculetin|SCHEMBL22922167|HY-N2746|BDBM50490819|MS-24925|CS-0023248|7-[(2E)-3,7-dimethylocta-2,6-dienoxy]-6-methoxy-chromen-2-one|7-(3,7-Dimethyl-2,6-octadiene-1-yloxy)-6-methoxy-2H-1-benzopyran-2-one |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 3.850 |
| Log Po/w (XLOGP3) : 5.210 |
| Log Po/w (WLOGP) : 4.870 |
| Log Po/w (MLOGP) : 3.160 |
| Log Po/w (SILICOS-IT) : 5.220 |
| Consensus Log Po/w : 4.460 |