3',4',6,7,8-Pentamethoxyflavone
Representations & DB's id
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| ChEBI: | None | |
|---|---|---|
| ChEMBL: | CHEMBL478762 | |
| PubChem: | 44584772 | |
| IUPAC: | 2-(3,4-dimethoxyphenyl)-6,7,8-trimethoxychromen-4-one | |
| Standard InChI: | InChI=1S/C20H20O7/c1-22-14-7-6-11(8-16(14)23-2)15-10-13(21)12-9-17(24-3)19(25-4)20(26-5)18(12)27-15/h6-10H,1-5H3 | |
| Standard InChI Key: | MNQMRHVEXBTNRO-UHFFFAOYSA-N | |
| SMILES: | COc1ccc(cc1OC)c1cc(=O)c2c(o1)c(OC)c(c(c2)OC)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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