active glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD009379 | 5.74 | 930.14 | C50H75O15N | CCC(C)[C@@H]1O[C@@]2(C=C[C@H]1C)C[C@@H]1C[C@H](CC=C(C)[C@H](O[C@@H]3C[C@H](OC)[C@H](O[C@@H]4C[C@H](OC)[C@H](NC(=O)OC)[C@H](C)O4)[C@H](C)O3)[C@H](C)C=CC=C3CO[C@@H]4[C@H](O)C(C)=C[C@H](C(=O)O1)[C@]34O)O2 |
|
GD016868 | -1.98 | 228.21 | C8H12O4N4 | C[C@@H]1O[C@H](n2cnc(C(N)=O)n2)[C@H](O)[C@H]1O |
|
GD001591 | -3.01 | 244.21 | C8H12O5N4 | NC(=O)c1ncn([C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)n1 |
|
GD004774 | 1.83 | 561.65 | C28H35O9NS | COc1c(O[C@@H]2O[C@H](C)[C@H](O)[C@H](O)[C@H]2O)cc2c(c1OC)-c1ccc(SC)c(=O)cc1[C@H](CNC(C)=O)CC2 |
|
GD008369 | -1.64 | 286.28 | C13H18O7 | OCc1ccc(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1 |
|
GD008906 | 2.15 | 342.5 | C18H30O4S | CC1OC(SCCC23C[C@H]4C[C@@H](C2)C[C@@H](C3)C4)C(O)C(O)C1O |
|
GD010531 | 2.61 | 564.67 | C30H44O10 | COCC(=O)O[C@@H]1C(O)[C@H](OCC23C[C@@H]4[C@H](C)CC[C@H]4C4(C=O)CC2C=C(C(C)C)C34C(=O)O)O[C@H](C)[C@H]1OC |
|
GD017943 | 4.52 | 1038.3 | C55H89O18 | C#CCC(C(=O)[O-])[C@]1(O)O[C@H]([C@H](C)[C@@H]2O[C@]3(CC[C@](C)([C@@H]4CC[C@](C)([C@@H]5O[C@H]([C@@H]6O[C@@](C)(O)[C@H](C)C[C@H]6C)C[C@H]5O[C@@H]5CC[C@H](OC)[C@H](C)O5)O4)O3)C[C@H](O)[C@H]2C)[C@H](OC)[C@H](O[C@@H]2CC[C@H](OC)[C@H](C)O2)[C@H]1C |
|
GD007147 | -0.84 | 298.32 | C11H14O4N4S | CSc1ncnc2c1ncn2C1OC(CO)C(O)C1O |
|
GD016681 | 1.22 | 816.05 | C40H73O12N5 | CC[C@@H]1OC(=O)[C@H](C)[C@H](O[C@@H]2C[C@@](C)(OC)[C@](O)(Cn3ccnn3)[C@H](C)O2)[C@H](C)[C@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C)[C@H]2O)[C@@](C)(O)C[C@H](C)CN[C@H](C)[C@H](O)[C@]1(C)O |