1,4,7-Trihydroxy-5-Methoxyfluoren-9-One
Representations & DB's id
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| ChEBI: | None | |
|---|---|---|
| ChEMBL: | CHEMBL216941 | |
| PubChem: | 44418788 | |
| IUPAC: | 1,4,7-trihydroxy-5-methoxyfluoren-9-one | |
| Standard InChI: | InChI=1S/C14H10O5/c1-19-10-5-6(15)4-7-11(10)12-8(16)2-3-9(17)13(12)14(7)18/h2-5,15-17H,1H3 | |
| Standard InChI Key: | QYZVZXXDXPZMHM-UHFFFAOYSA-N | |
| SMILES: | COc1cc(O)cc2c1c1c(O)ccc(c1C2=O)O | |
Molecular propeties
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| AlogP: | 2.02 | |
|---|---|---|
| Hydrogen bonds acceptors: | 5 | |
| Hydrogen bonds donors: | 3 | |
| Rotatable bonds: | 1 | |
| Number of rings: | 3 | |
| Molecular Weight: | 258.05 | |
| Topological polar surface area: | 87 | |
| Number of aromatic rings: | 2 | |
| Fsp3: | 0.071 | |
| Number of carbons: | 14 | |
In vitro data
| Activity Type | Activity Value | Target Name | UniProt ID | Ref. |
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