2,5-Dimethyl-7-Hydroxychromone
Representations & DB's id
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| ChEBI: | None | |
|---|---|---|
| ChEMBL: | CHEMBL509319 | |
| PubChem: | 5316891 | |
| IUPAC: | 7-hydroxy-2,5-dimethylchromen-4-one | |
| Standard InChI: | InChI=1S/C11H10O3/c1-6-3-8(12)5-10-11(6)9(13)4-7(2)14-10/h3-5,12H,1-2H3 | |
| Standard InChI Key: | CRNGFKXWIYTEPH-UHFFFAOYSA-N | |
| SMILES: | Oc1cc(C)c2c(c1)oc(cc2=O)C | |
Molecular propeties
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| AlogP: | 2.12 | |
|---|---|---|
| Hydrogen bonds acceptors: | 3 | |
| Hydrogen bonds donors: | 1 | |
| Rotatable bonds: | 0 | |
| Number of rings: | 2 | |
| Molecular Weight: | 190.06 | |
| Topological polar surface area: | 46.5 | |
| Number of aromatic rings: | 2 | |
| Fsp3: | 0.182 | |
| Number of carbons: | 11 | |
Plant sources
In vitro data
| Activity Type | Activity Value | Target Name | UniProt ID | Ref. |
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