| Phytochemical Name : Pedicellin |
| PCNDIDP0035 |
| Pubchem CID : 5925916 |
| Molecular formula: C20H22O6 |
| Canonical SMILES : COC1=C(C(=C(C(=C1OC)OC)OC)OC)C(=O)C=CC2=CC=CC=C2 |
Synonymes : PEDICELLIN|518-58-1|NSC 255994|2-Propen-1-one, 1-(pentamethoxyphenyl)-3-phenyl-, (E)-|(E)-1-(Pentamethoxyphenyl)-3-phenyl-2-propen-1-one|NSC-255994|Pedicellin (chalcone)|SCHEMBL1201269|CHEMBL1998453|7Y8622K9HX|LMPK12120363|NSC255994|Chalcone, 2',3',4',5',6'-pentamethoxy-|2-Propen-1-one, 1-(pentamethoxyphenyl)-3-phenyl-|1-(2,3,4,5,6-pentamethoxyphenyl)-3-phenylprop-2-en-1-one|80405-09-0 |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 3.850 |
| Log Po/w (XLOGP3) : 3.550 |
| Log Po/w (WLOGP) : 3.520 |
| Log Po/w (MLOGP) : 1.670 |
| Log Po/w (SILICOS-IT) : 4.240 |
| Consensus Log Po/w : 3.360 |