Quercetagetin
Representations & DB's id
| ||
| ChEBI: | CHEBI:8695 | |
|---|---|---|
| ChEMBL: | CHEMBL413552 | |
| PubChem: | 5281680 | |
| IUPAC: | 2-(3,4-dihydroxyphenyl)-3,5,6,7-tetrahydroxychromen-4-one | |
| Standard InChI: | InChI=1S/C15H10O8/c16-6-2-1-5(3-7(6)17)15-14(22)13(21)10-9(23-15)4-8(18)11(19)12(10)20/h1-4,16-20,22H | |
| Standard InChI Key: | ZVOLCUVKHLEPEV-UHFFFAOYSA-N | |
| SMILES: | Oc1ccc(cc1O)c1oc2cc(O)c(c(c2c(=O)c1O)O)O | |
Molecular propeties
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| AlogP: | 1.69 | |
|---|---|---|
| Hydrogen bonds acceptors: | 8 | |
| Hydrogen bonds donors: | 6 | |
| Rotatable bonds: | 1 | |
| Number of rings: | 3 | |
| Molecular Weight: | 318.04 | |
| Topological polar surface area: | 148 | |
| Number of aromatic rings: | 3 | |
| Fsp3: | 0 | |
| Number of carbons: | 15 | |