General Characteristics
| NatID | 697 |
| Common Name | 7-hydroxyflavanone |
| Molecular Formula | C15H12O3 |
| Chemical Class | Flavonoids > Flavans |
| Molecular Weight | 240.079 g/mol |
| Other names |
Representations
| Smiles | O=C1CC(c2ccccc2)Oc2cc(O)ccc21 |
| Inchi | InChI=1S/C15H12O3/c16-11-6-7-12-13(17)9-14(18-15(12)8-11)10-4-2-1-3-5-10/h1-8,14,16H,9H2 |
| Inchi Key | SWAJPHCXKPCPQZ-UHFFFAOYSA-N |
| 3D Structure |
Calculated Properties
| clogP | 3.10 |
| TPSA | 46.53 |
| HBD | 1 |
| HBA | 3 |
| Rotatable Bonds | 1 |
| Aromatic Rings | 2 |
| Heavy Atoms | 18 |
| Aromatic Carbocycles | 2 |
| Aromatic Heterocycles | 0 |
| Number of NO | 3 |
Experiments
| EID | Source | Semisynthetic? | Confidence level | References |
|---|---|---|---|---|
| 9859 | Bidens aurea | No | Unknown | Ortega, C., María, A., & Gianello, J. (2000). Chemical Components and Biological Activity of Bidens Subalternans, B. Aurea (Astereaceae) and Zuccagnia Puntacta (Fabaceae). Molecules, 5(12), 465–467. https://doi.org/10.3390/50300465 |
| Bioassay ID | NPASS ID | Target | Activity type | Activity |
|---|---|---|---|---|
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