(2R,3R)-2',3,5,7-Tetrahydroxy Flavanonol
Representations & DB's id
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| ChEBI: | None | |
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| ChEMBL: | CHEMBL3634564 | |
| PubChem: | 3082330 | |
| IUPAC: | (2R,3R)-3,5,7-trihydroxy-2-(2-hydroxyphenyl)-2,3-dihydrochromen-4-one | |
| Standard InChI: | InChI=1S/C15H12O6/c16-7-5-10(18)12-11(6-7)21-15(14(20)13(12)19)8-3-1-2-4-9(8)17/h1-6,14-18,20H/t14-,15+/m0/s1 | |
| Standard InChI Key: | BJNCWLSOQIVKIX-LSDHHAIUSA-N | |
| SMILES: | Oc1cc2O[C@H](c3ccccc3O)[C@H](C(=O)c2c(c1)O)O | |
Molecular propeties
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| AlogP: | 1.48 | |
|---|---|---|
| Hydrogen bonds acceptors: | 6 | |
| Hydrogen bonds donors: | 4 | |
| Rotatable bonds: | 1 | |
| Number of rings: | 3 | |
| Molecular Weight: | 288.06 | |
| Topological polar surface area: | 107 | |
| Number of aromatic rings: | 2 | |
| Fsp3: | 0.133 | |
| Number of carbons: | 15 | |
In vitro data
| Activity Type | Activity Value | Target Name | UniProt ID | Ref. |
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