| Compound | 3-O-[alpha-L-Arabinopyranosyl-(1->2)-alpha-L-arabinopyranosyl-(1->6)-2-acetamido-2-deoxy-beta-D-glucopyranosyl]oleanolic acid |
| NPACT-Id | NPACT00134 |
| IUPAC | - |
| Synonyms | - |
| PubChem Id | - |
| Class | Saponin |
| In-vitro anticancer activity | 1 cancer cell lines |
| In-Vivo anticancer activity | No |
| Targets | No targets found |
| Properties | Physical Elemental Topological |
| InChi Key | OOZNMXOXLXXCTO-HHTANHPVSA-N |
| InChi | 1S/C48H79NO16/c1-23(50)49-32-36(56)35(55)28(22-62-41-38(34(54)27(52)21-61-41)65-40-37(57)33(53)26(51)20-60-40)63-39(32)64-31-12-13-45(6)29(44(31,4)5)11-14-47(8)30(45)10-9-24-25-19-43(2,3)15-17-48(25,42(58)59)18-16-46(24,47)7/h24-41,51-57H,9-22H2,1-8H3,(H, |
| SMILES | [C@H]1([C@@H]([C@H]([C@@H](OC1)O[C@@H]1[C@@H](OC[C@@H]([C@H]1O)O)OC[C@@H]1[C@@H](O)[C@H]([C@@H]([C@@H](O1)O[C@@H]1CC[C@]2([C@H](C1(C)C)CC[C@@]1([C@@H]2CC[C@H]2[C@]1(C[CH][C@@]1([C@@H]2CC([CH]C1)(C)C)C(=O)O)C)C)C)NC(=O)C)O)O)O)O |
|
SMART | [H]C1C[C@@]2(C([H])C[C@]3([#6])[C@H](CC[C@@H]4[C@@]5([#6])CC[C@@H](O[C@@H]6O[C@H](CO[C@@H]7OC[C@H](O)[C@@H](O)[C@@H]7O[C@@H]7OC[C@H](O)[C@H](O)[C@H]7O)[C@@H](O)[C@@H](O)[C@@H]6N([H])C([#6])=O)[C@@]([#6])([#6])[C@@H]5CC[C@@]34[#6])[C@H]2C[C@@]1([#6])[#6])C(O)=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 | No |
| Veber filter | No |
| Muegge Filter | No |
| Similarity Search | Human metabolite database | FDA approved drugs |