| Compound | 3-O-[alpha-L-rhamnopyranosyl(1->2)-beta-D-glucopyranosyl(1->2)-beta-D-glucuronopyranosyl]olean-12-en-3-beta,22-beta,24-triol methyl ester |
| NPACT-Id | NPACT00137 |
| IUPAC | - |
| Synonyms | - |
| PubChem Id | - |
| 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 | PQZZWDLMYVGODK-HOFTWDLRSA-N |
| InChi | 1S/C41H66O15/c1-35(2)15-20-19-9-10-22-36(3)13-12-24(37(4,17-42)21(36)11-14-39(22,6)40(19,7)52-18-38(20,5)23(43)16-35)55-41(8)31(27(46)26(45)30(56-41)32(49)50)53-34-29(48)25(44)28(47)33(51)54-34/h9,20-31,33-34,42-48,51H,10-18H2,1-8H3,(H,49,50)/t20-,21+,22- |
| SMILES | C1C[C@H]([C@@]([C@H]2[C@]1([C@H]1[C@@](CC2)([C@]2(C(=CC1)[C@H]1[C@@](CO2)([C@@H](CC(C1)(C)C)O)C)C)C)C)(CO)C)O[C@]1(O[C@@H]([C@H]([C@@H]([C@H]1O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)O)O)O)C(=O)O)C |
|
SMART | [#6][C@]1([#6])C[C@@H](O)[C@]2([#6])CO[C@]3([#6])C(=CC[C@H]4[C@@]5([#6])CC[C@@H](O[C@@]6([#6])O[C@@H]([C@@H](O)[C@H](O)[C@H]6O[C@@H]6O[C@H](O)[C@@H](O)[C@H](O)[C@H]6O)C(O)=O)[C@]([#6])(CO)[C@@H]5CC[C@@]34[#6])[C@@H]2C1 |
| 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 |