1,3,7-Trihydroxyxanthone
Representations & DB's id
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| ChEBI: | CHEBI:5323 | |
|---|---|---|
| ChEMBL: | CHEMBL361025 | |
| PubChem: | 5281635 | |
| IUPAC: | 1,3,7-trihydroxyxanthen-9-one | |
| Standard InChI: | InChI=1S/C13H8O5/c14-6-1-2-10-8(3-6)13(17)12-9(16)4-7(15)5-11(12)18-10/h1-5,14-16H | |
| Standard InChI Key: | JJUNZBRHHGLJQW-UHFFFAOYSA-N | |
| SMILES: | Oc1cc(O)c2c(c1)oc1c(c2=O)cc(cc1)O | |
Molecular propeties
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| AlogP: | 2.06 | |
|---|---|---|
| Hydrogen bonds acceptors: | 5 | |
| Hydrogen bonds donors: | 3 | |
| Rotatable bonds: | 0 | |
| Number of rings: | 3 | |
| Molecular Weight: | 244.04 | |
| Topological polar surface area: | 87 | |
| Number of aromatic rings: | 3 | |
| Fsp3: | 0 | |
| Number of carbons: | 13 | |
Plant sources
In vitro data
| Activity Type | Activity Value | Target Name | UniProt ID | Ref. |
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