| Compound | Ferruginin B |
| NPACT-Id | NPACT01207 |
| IUPAC | - |
| Synonyms | - |
| PubChem Id | 21680812 |
| Class | Terpenoids |
| In-vitro anticancer activity | 3 cancer cell lines |
| In-Vivo anticancer activity | No |
| Targets | No targets found |
| Properties | Physical Elemental Topological |
| InChi Key | SAZNPNYLSKFIJG-UHFFFAOYSA-N |
| InChi | 1S/C30H36O4/c1-17(2)8-9-22-27(32)26-23(16-21-14-20(7)15-24(31)25(21)28(26)33)30(29(22)34,12-10-18(3)4)13-11-19(5)6/h8,10-11,14-16,31-33H,9,12-13H2,1-7H3 |
| SMILES | O=C1C(c2c(C(=C1CC=C(C)C)O)c(O)c1c(c2)cc(cc1O)C)(CC=C(C)C)CC=C(C)C |
|
SMART | [H]OC1=C([H])C(=C([H])C2=C([H])C3=C(C(O[H])=C12)C(O[H])=C(C(=O)[C@]3(C([H])([H])C([H])=C(/C([H])([H])[H])C([H])([H])[H])C([H])([H])C([H])=C(/C([H])([H])[H])C([H])([H])[H])C([H])([H])C([H])=C(/C([H])([H])[H])C([H])([H])[H])C([H])([H])[H] |
| 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 | No |
| Ghose filter | No |
| Veber filter | Yes |
| Muegge Filter | No |
| Similarity Search | Human metabolite database | FDA approved drugs |