| Phytochemical Name : 2-(4-Hydroxy-3-methoxyphenyl)-5-(3-hydroxypropyl)-7-methoxy-1-benzofuran-3-carbaldehyde |
| PCNDIDOT0465 |
| Pubchem CID : 6709746 |
| Molecular formula: C20H20O6 |
| Canonical SMILES : COC1=CC(=CC2=C1OC(=C2C=O)C3=CC(=C(C=C3)O)OC)CCCO |
Synonymes : CHEMBL42639|2-(4-Hydroxy-3-methoxy-phenyl)-5-(3-hydroxy-propyl)-7-methoxy-benzofuran-3-carbaldehyde|XH-14|ICCB1_000076|SCHEMBL3486438|BDBM50048468|2-(4-hydroxy-3-methoxyphenyl)-5-(3-hydroxypropyl)-7-methoxy-1-benzofuran-3-carbaldehyde|5-(3-hydroxypropyl)-7-methoxy-2-(3'-methoxy-4'-hydroxyphenyl)-3-benzo[b]furan-carbaldehyde|5-(3-hydroxy-propyl)-7-methoxy-2-(3''-methoxy-4''-hydroxy-phenyl)-3-benzo[b]furanecarbaldehyde |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 3.020 |
| Log Po/w (XLOGP3) : 2.970 |
| Log Po/w (WLOGP) : 3.560 |
| Log Po/w (MLOGP) : 0.930 |
| Log Po/w (SILICOS-IT) : 4.380 |
| Consensus Log Po/w : 2.970 |