| Compound | 5-epi-Vibsanin C |
| NPACT-Id | NPACT01518 |
| IUPAC | [(Z)-2-[(1R,2S,7S)-5-(hydroxymethyl)-2-methyl-2-(4-methylpent-3-enyl)-6-oxo-7-(2-oxopropyl)cyclohept-4-en-1-yl]ethenyl] 3-methylbut-2-enoate |
| Synonyms | - |
| PubChem Id | 11327504 |
| Class | Terpenoids |
| In-vitro anticancer activity | 1 cancer cell lines |
| In-Vivo anticancer activity | No |
| Targets | No targets found |
| Properties | Physical Elemental Topological |
| InChi Key | FUJYXGPHSQJMJL-AWJLUJOMSA-N |
| InChi | 1S/C25H36O5/c1-17(2)8-7-11-25(6)12-9-20(16-26)24(29)21(15-19(5)27)22(25)10-13-30-23(28)14-18(3)4/h8-10,13-14,21-22,26H,7,11-12,15-16H2,1-6H3/b13-10-/t21-,22+,25-/m0/s1 |
| SMILES | O=C1[C@H]([C@H]([C@](CC=C1CO)(CCC=C(C)C)C)/C=COC(=O)C=C(C)C)CC(=O)C |
|
SMART | OCC1=CC[C@]([#6])(CCC=C([#6])[#6])[C@H](C=C/OC(=O)C=C([#6])[#6])[C@H](CC(=O)[#6])C1=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 | Yes |
| Ghose filter | Yes |
| Veber filter | Yes |
| Muegge Filter | Yes |
| Similarity Search | Human metabolite database | FDA approved drugs |