| Phytochemical Name : Coniferyl ferulate |
| PCNDIDC0235 |
| Pubchem CID : 6441913 |
| Molecular formula: C20H20O6 |
| Canonical SMILES : COC1=C(C=CC(=C1)C=CCOC(=O)C=CC2=CC(=C(C=C2)O)OC)O |
Synonymes : Coniferyl ferulate|63644-62-2|3-(4-Hydroxy-3-methoxyphenyl)allyl 3-(4-hydroxy-3-methoxyphenyl)acrylate|UNII-3SK9G87Y9Q|3SK9G87Y9Q|[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enyl] (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate|CHEMBL3823769|2-Propenoic acid, 3-(4-hydroxy-3-methoxyphenyl)-, 3-(4-hydroxy-3-methoxyphenyl)-2-propenyl ester|coniferylferulate|2-PROPENOIC ACID, 3-(4-HYDROXY-3-METHOXYPHENYL)-, 3-(4-HYDROXY-3-METHOXYPHENYL)-2-PROPEN-1-YL ESTER|SCHEMBL10054940|HY-N1916|BDBM50185689|MFCD13195559|AKOS016004107|AC-33984|MS-25579|CS-0018227|C17855|F17655|A868078|Q27257982|3-Methoxy-4-hydroxy-trans-cinnamic acid 3-methoxy-4-hydroxy-trans-cinnamyl ester |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 3.760 |
| Log Po/w (XLOGP3) : 3.570 |
| Log Po/w (WLOGP) : 3.170 |
| Log Po/w (MLOGP) : 2.140 |
| Log Po/w (SILICOS-IT) : 3.630 |
| Consensus Log Po/w : 3.250 |