Compound | Ponciretin |
NPACT-Id | NPACT00877 |
IUPAC | 7-hydroxy-2-(4-methoxyphenyl)-4-oxo-2,3-dihydrochromen-5-olate |
Synonyms | 4'-methoxy-5,7-dihydroxy flavanone |
PubChem Id | 25201019 |
Class | Flavonoid |
In-vitro anticancer activity | 3 cancer cell lines |
In-Vivo anticancer activity | No |
Targets | No targets found |
Properties | Physical Elemental Topological |
InChi Key | HMUJXQRRKBLVOO-UHFFFAOYSA-M |
InChi | 1S/C16H14O5/c1-20-11-4-2-9(3-5-11)14-8-13(19)16-12(18)6-10(17)7-15(16)21-14/h2-7,14,17-18H,8H2,1H3/p-1 |
SMILES | O1[C@H](CC(=O)c2c1cc(O)cc2[O-])c1ccc(OC)cc1 |
SMART | [#6]OC1=CC=C(C=C1)[C@H]1CC(=O)C2=C([O-])C=C(O)C=C2O1 |
CAS No. | - |
|
Structure Download |
|
Cross Refrence in other databases |
Super Natural | - |
CTD | - |
HIT | - |
NCI-60 GI50 data | - |
Suppliers | NA, |
Drug-Likeliness Filters | Lipinski's rule of five | Yes |
Ghose filter | Yes |
Veber filter | Yes |
Muegge Filter | Yes |
Similarity Search | Human metabolite database | FDA approved drugs |