| Compound | Wikstroelides E |
| NPACT-Id | NPACT01015 |
| IUPAC | - |
| Synonyms | - |
| PubChem Id | - |
| Class | Terpenoids |
| In-vitro anticancer activity | 2 cancer cell lines |
| In-Vivo anticancer activity | No |
| Targets | No targets found |
| Properties | Physical Elemental Topological |
| InChi Key | YWWRNHONLWHJHH-WRUHYVIPSA-N |
| InChi | 1S/C39H50O8/c1-20(2)37-34-18-14-9-7-8-11-15-21(3)26-22(4)29(43-23(5)25-16-12-10-13-17-25)35(42)28(26)36-24(6)38(34,47-36)39(37,46-34)31(45-37)27(36)30-33(19-40,44-30)32(35)41/h10,12-13,16-17,21-22,24,26-32,40-42H,1,5,7-9,11,14-15,18-19H2,2-4,6H3/t21-,22-, |
| SMILES | [C@]123[C@@H]4[C@]5([C@@H]([C@]6([C@@H]([C@@H]1[C@H]1[C@]78[C@@]([C@@H]2C)(O3)[C@]([C@@]7(C(=C)C)O1)(O8)CCCCCCC[C@@H]([C@H]4[C@@H]([C@H]5OC(=C)c1ccccc1)C)C)O6)CO)O)O |
|
SMART | [H][C@]12[C@H]([#6])[C@@H](OC(=C)C3=CC=CC=C3)[C@@]3(O)C1[C@]14O[C@@]5([C@@H]1[#6])[C@@]1(CCCCCCC[C@]2([H])[#6])O[C@@]52[C@@H](O[C@]12C([#6])=C)[C@H]4[C@H]1O[C@@]1(CO)[C@H]3O |
| 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 | No |
| Veber filter | Yes |
| Muegge Filter | No |
| Similarity Search | Human metabolite database | FDA approved drugs |