| Compound | 3,5,7,3',4'-pentahydroxyflavone-3-O-beta-D-glucopyranoside |
| NPACT-Id | NPACT00106 |
| IUPAC | - |
| Synonyms | - |
| PubChem Id | - |
| 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 | KBLNZSIRZVGYIY-KAKXMVNSSA-N |
| InChi | 1S/C20H18NO10/c22-8-10(2-4-16(27)28)21-31-20-18(29)17-14(26)6-11(23)7-15(17)30-19(20)9-1-3-12(24)13(25)5-9/h1,3,5-7,10,19-21,23-26H,2,4H2,(H,27,28)/t10-,19+,20-/m0/s1 |
| SMILES | c1c(cc(c2c1O[C@@H]([C@H](C2=O)ON[C@@H](CCC(=O)O)C=O)c1cc(c(cc1)O)O)O)O |
|
SMART | OC(=O)CC[C@H](NO[C@@H]1[C@H](OC2=C(C(O)=CC(O)=C2)C1=O)C1=CC(O)=C(O)C=C1)C=O |
| CAS No. | - |
|
Structure
Download | 
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| Cross Refrence in other databases |
| Super Natural | - |
| CTD | - |
| HIT | - |
| NCI-60 GI50 data | - |
| Suppliers | NA, |
| Drug-Likeliness Filters | Lipinski's rule of five | No |
| Ghose filter | Yes |
| Veber filter | No |
| Muegge Filter | No |
| Similarity Search | Human metabolite database | FDA approved drugs |