NatID | 1665 |
Common Name | NatID_1665 |
Molecular Formula | C15H12O6 |
Chemical Class | Flavonoids > Flavans |
Molecular Weight | 288.063 g/mol |
Other names | 20725-03-5 |
Smiles | O=C1c2ccc(O)cc2O[C@H](c2ccc(O)c(O)c2)[C@H]1O |
Inchi | InChI=1S/C15H12O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,14-18,20H/t14-,15+/m0/s1 |
Inchi Key | FNUPUYFWZXZMIE-LSDHHAIUSA-N |
3D Structure |
clogP | 1.48 |
TPSA | 107.22 |
HBD | 4 |
HBA | 6 |
Rotatable Bonds | 1 |
Aromatic Rings | 2 |
Heavy Atoms | 21 |
Aromatic Carbocycles | 2 |
Aromatic Heterocycles | 0 |
Number of NO | 6 |
EID | Source | Semisynthetic? | Confidence level | References |
---|---|---|---|---|
10368 | Prosopidastrum globosum | No | Low | Agnese, A. M., Chiale, C. A., Cabrera, J. L., & Juliani, H. R. (1986). Two New Flavonoids from Prosopidastrum globosum. Journal of Natural Products, 49(3), 528–529. https://doi.org/10.1021/np50045a029 |
Bioassay ID | NPASS ID | Target | Activity type | Activity |
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