Características Generales
| NatID | 285 |
| Nombre Común | 3,7-Dihydroxy-8-Methoxyflavone |
| Fórmula Molecular | C16H12O5 |
| Tipo Químico | Flavonoids > Flavones |
| Peso Molecular | 284.068 g/mol |
| Otros nombres | 3,7-dihydroxy-8-metoxyflavone |
Representaciones
| Smiles | COc1c(O)ccc2c(=O)c(O)c(-c3ccccc3)oc12 |
| Inchi | InChI=1S/C16H12O5/c1-20-16-11(17)8-7-10-12(18)13(19)14(21-15(10)16)9-5-3-2-4-6-9/h2-8,17,19H,1H3 |
| Inchi Key | GFZSBWIGTNTNKS-UHFFFAOYSA-N |
| Estructura 3D |
Propiedades calculadas
| clogP | 2.88 |
| TPSA | 79.90 |
| HBD | 2 |
| HBA | 5 |
| Enlaces Rotables | 2 |
| Anillos aromáticos | 3 |
| Átomos pesados | 21 |
| Carbociclos Aromáticos | 2 |
| Heterociclos Aromáticos | 1 |
| Número de NO | 5 |
Experimentos
| EID | Fuente | Semisintético? | Confidence level | Referencias |
|---|---|---|---|---|
| 9792 | Zuccagnia punctata | No | High | Pederiva, R., & Giordano, O. S. (1984). 37-Dihydroxy-8-methoxyflavone from Zuccagnia punctata. Phytochemistry, 23(6), 1340–1341. https://doi.org/10.1016/s0031-9422(00)80459-8 |
| Bioassay ID | NPASS ID | Target | Activity type | Activity |
|---|---|---|---|---|
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