Formonetin
Representations & DB's id
| ||
| ChEBI: | CHEBI:9507 | |
|---|---|---|
| ChEMBL: | CHEMBL239028 | |
| PubChem: | 5281812 | |
| IUPAC: | 6,7-dihydroxy-3-(4-methoxyphenyl)chromen-4-one | |
| Standard InChI: | InChI=1S/C16H12O5/c1-20-10-4-2-9(3-5-10)12-8-21-15-7-14(18)13(17)6-11(15)16(12)19/h2-8,17-18H,1H3 | |
| Standard InChI Key: | GCWOYVFHJDNKIN-UHFFFAOYSA-N | |
| SMILES: | COc1ccc(cc1)c1coc2c(c1=O)cc(c(c2)O)O | |
Molecular propeties
| ||
| AlogP: | 2.88 | |
|---|---|---|
| Hydrogen bonds acceptors: | 5 | |
| Hydrogen bonds donors: | 2 | |
| Rotatable bonds: | 2 | |
| Number of rings: | 3 | |
| Molecular Weight: | 284.07 | |
| Topological polar surface area: | 76 | |
| Number of aromatic rings: | 3 | |
| Fsp3: | 0.062 | |
| Number of carbons: | 16 | |
In vitro data
| Activity Type | Activity Value | Target Name | UniProt ID | Ref. |
|---|