Hydroxy-3,7-Dimethoxyflavone
Representations & DB's id
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ChEBI: | None | |
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ChEMBL: | CHEMBL1097683 | |
PubChem: | 5748697 | |
IUPAC: | 5-hydroxy-3,7-dimethoxy-2-phenylchromen-4-one | |
Standard InChI: | InChI=1S/C17H14O5/c1-20-11-8-12(18)14-13(9-11)22-16(17(21-2)15(14)19)10-6-4-3-5-7-10/h3-9,18H,1-2H3 | |
Standard InChI Key: | OYCOUDKDRFJOCP-UHFFFAOYSA-N | |
SMILES: | COc1c(oc2c(c1=O)c(O)cc(c2)OC)c1ccccc1 |
Molecular propeties
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AlogP: | 3.18 | |
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Hydrogen bonds acceptors: | 5 | |
Hydrogen bonds donors: | 1 | |
Rotatable bonds: | 3 | |
Number of rings: | 3 | |
Molecular Weight: | 298.08 | |
Topological polar surface area: | 65 | |
Number of aromatic rings: | 3 | |
Fsp3: | 0.118 | |
Number of carbons: | 17 |
In vitro data
Activity Type | Activity Value | Target Name | UniProt ID | Ref. |
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