5,7-Dihydroxy-3,3',4',6-Tetramethoxyflavone
Representations & DB's id
| ||
| ChEBI: | None | |
|---|---|---|
| ChEMBL: | CHEMBL3407748 | |
| PubChem: | 5379563 | |
| IUPAC: | 2-(3,4-dimethoxyphenyl)-5,7-dihydroxy-3,6-dimethoxychromen-4-one | |
| Standard InChI: | InChI=1S/C19H18O8/c1-23-11-6-5-9(7-12(11)24-2)17-19(26-4)16(22)14-13(27-17)8-10(20)18(25-3)15(14)21/h5-8,20-21H,1-4H3 | |
| Standard InChI Key: | SDTFURCSGWUESP-UHFFFAOYSA-N | |
| SMILES: | COc1cc(ccc1OC)c1oc2cc(O)c(c(c2c(=O)c1OC)O)OC | |
Molecular propeties
| ||
| AlogP: | 2.91 | |
|---|---|---|
| Hydrogen bonds acceptors: | 8 | |
| Hydrogen bonds donors: | 2 | |
| Rotatable bonds: | 5 | |
| Number of rings: | 3 | |
| Molecular Weight: | 374.1 | |
| Topological polar surface area: | 104 | |
| Number of aromatic rings: | 3 | |
| Fsp3: | 0.211 | |
| Number of carbons: | 19 | |
In vitro data
| Activity Type | Activity Value | Target Name | UniProt ID | Ref. |
|---|