5,7,8,3',4'-Pentamethoxyflavone
Representations & DB's id
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| ChEBI: | None | |
|---|---|---|
| ChEMBL: | CHEMBL451707 | |
| PubChem: | 632135 | |
| IUPAC: | 2-(3,4-dimethoxyphenyl)-5,7,8-trimethoxychromen-4-one | |
| Standard InChI: | InChI=1S/C20H20O7/c1-22-13-7-6-11(8-15(13)23-2)14-9-12(21)18-16(24-3)10-17(25-4)19(26-5)20(18)27-14/h6-10H,1-5H3 | |
| Standard InChI Key: | UYCWETIUOAGWIL-UHFFFAOYSA-N | |
| SMILES: | COc1cc(ccc1OC)c1cc(=O)c2c(o1)c(OC)c(cc2OC)OC | |
Molecular propeties
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| AlogP: | 3.5 | |
|---|---|---|
| Hydrogen bonds acceptors: | 7 | |
| Hydrogen bonds donors: | 0 | |
| Rotatable bonds: | 6 | |
| Number of rings: | 3 | |
| Molecular Weight: | 372.12 | |
| Topological polar surface area: | 72.4 | |
| Number of aromatic rings: | 3 | |
| Fsp3: | 0.25 | |
| Number of carbons: | 20 | |
Plant sources
In vitro data
| Activity Type | Activity Value | Target Name | UniProt ID | Ref. |
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