| Compound | Javanicoside D |
| NPACT-Id | NPACT00693 |
| IUPAC | - |
| Synonyms | - |
| PubChem Id | 11227971 |
| 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 | BZHBPAJGRSEIHP-VHQGUAROSA-N |
| InChi | 1S/C35H48O17/c1-7-14(32(3,4)46)8-19(37)52-25-27-34-12-48-35(27,31(45)47-6)28(43)24(42)26(34)33(5)10-16(20(38)13(2)15(33)9-18(34)51-29(25)44)49-30-23(41)22(40)21(39)17(11-36)50-30/h8,10,13,15,17-18,21-28,30,36,39-43,46H,7,9,11-12H2,1-6H3/b14-8+/t13-,15-,17 |
| SMILES | O1[C@]2([C@H]3[C@]4([C@@H]([C@@]5([C@@H](C[C@H]4OC(=O)[C@@H]3OC(=O)/C=C(/C(O)(C)C)CC)[C@@H](C(=O)C(=C5)O[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)CO)C)C)[C@@H](O)[C@@H]2O)C1)C(=O)OC |
|
SMART | [H]OC([H])([H])[C@@]1([H])O[C@@]([H])(OC2=C([H])[C@@]3(C([H])([H])[H])[C@@]([H])(C([H])([H])[C@@]4([H])OC(=O)[C@]([H])(OC(=O)C([H])=C(/C([H])([H])C([H])([H])[H])[C@](O[H])(C([H])([H])[H])C([H])([H])[H])[C@@]5([H])[C@@]6(OC([H])([H])[C@]45[C@]3([H])[C@@]([H])(O[H])[C@]6([H])O[H])C(=O)OC([H])([H])[H])[C@@]([H])(C2=O)C([H])([H])[H])[C@]([H])(O[H])[C@@]([H])(O[H])[C@]1([H])O[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 |