Pratensein
Representations & DB's id
| ||
| ChEBI: | CHEBI:8359 | |
|---|---|---|
| ChEMBL: | CHEMBL252904 | |
| PubChem: | 5281803 | |
| IUPAC: | 5,7-dihydroxy-3-(3-hydroxy-4-methoxyphenyl)chromen-4-one | |
| Standard InChI: | InChI=1S/C16H12O6/c1-21-13-3-2-8(4-11(13)18)10-7-22-14-6-9(17)5-12(19)15(14)16(10)20/h2-7,17-19H,1H3 | |
| Standard InChI Key: | FPIOBTBNRZPWJW-UHFFFAOYSA-N | |
| SMILES: | COc1ccc(cc1O)c1coc2c(c1=O)c(O)cc(c2)O | |
Molecular propeties
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| AlogP: | 2.59 | |
|---|---|---|
| Hydrogen bonds acceptors: | 6 | |
| Hydrogen bonds donors: | 3 | |
| Rotatable bonds: | 2 | |
| Number of rings: | 3 | |
| Molecular Weight: | 300.06 | |
| Topological polar surface area: | 96.2 | |
| Number of aromatic rings: | 3 | |
| Fsp3: | 0.062 | |
| Number of carbons: | 16 | |
Plant sources
In vitro data
| Activity Type | Activity Value | Target Name | UniProt ID | Ref. |
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