| Compound | Yunnanin A |
| NPACT-Id | NPACT01028 |
| IUPAC | - |
| Synonyms | - |
| PubChem Id | 44584206 |
| Class | Aminoacids and peptides |
| In-vitro anticancer activity | 4 cancer cell lines |
| In-Vivo anticancer activity | No |
| Targets | No targets found |
| Properties | Physical Elemental Topological |
| InChi Key | GIKMZVPXQPZWDF-FWEHEUNISA-N |
| InChi | 1S/C34H41N7O8/c42-23-12-10-22(11-13-23)16-24-31(46)37-20-30(45)40-14-4-9-27(40)33(48)39-25(17-21-6-2-1-3-7-21)34(49)41-15-5-8-26(41)32(47)36-18-28(43)35-19-29(44)38-24/h1-3,6-7,10-13,24-27,42H,4-5,8-9,14-20H2,(H,35,43)(H,36,47)(H,37,46)(H,38,44)(H,39,48)/ |
| SMILES | O=C1N2[C@@H](CCC2)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)NCC(=O)N2[C@@H](CCC2)C(=O)N[C@H]1Cc1ccccc1)Cc1ccc(O)cc1 |
|
SMART | [H]OC1=C([H])C([H])=C(C([H])=C1[H])C([H])([H])[C@]1([H])N([H])C(=O)C([H])([H])N([H])C(=O)C([H])([H])N([H])C(=O)[C@@]2([H])N(C(=O)[C@@]([H])(N([H])C(=O)[C@@]3([H])N(C(=O)C([H])([H])N([H])C1=O)C([H])([H])C([H])([H])C3([H])[H])C([H])([H])C1=C([H])C([H])=C([H])C([H])=C1[H])C([H])([H])C([H])([H])C2([H])[H] |
| 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 | No |
| Muegge Filter | No |
| Similarity Search | Human metabolite database | FDA approved drugs |