active glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD039675 | 3.61 | 991.93 | C36H64O17N7P3S | CCCCCCCCCCCC[C@H](C)C(=O)SCCNC(=O)CCNC(=O)[C@@H](O)C(C)(C)CO[P@](=O)(O)O[P@](=O)(O)OC[C@H]1O[C@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O |
|
GD039676 | -1.25 | 260.2 | C6H13O7PS | CSC[C@@H](O)[C@@H](O)C(=O)COP(=O)(O)O |
|
GD001592 | -2.31 | 122.12 | C4H10O4 | OC[C@H](O)[C@H](O)CO |
|
GD039677 | -1.78 | 815.65 | C32H34O15N9P | NC(=O)c1ncn([C@H]2O[C@H](COP(=O)(O)O)[C@H](O)[C@@H]2O)c1C=CC(=O)N(Cc1ccc2nc(N)[nH]c(=O)c2n1)c1ccc(C(=O)N[C@H](CCC(=O)O)C(=O)O)cc1 |
|
GD039678 | 2.58 | 768.91 | C42H52O8N6 | CC(C)[C@@H](NC(=O)[C@@H](OCc1ccccc1)[C@@H](O)[C@@H](O)[C@@H](OCc1ccccc1)C(=O)N[C@@H](C(=O)NCc1ccccn1)C(C)C)C(=O)NCc1ccccn1 |
|
GD039679 | 3.76 | 663.14 | C37H36O7N2FCl | O=C(NCc1c(F)cccc1Cl)[C@H](OCc1ccccc1)[C@@H](O)[C@@H](O)[C@@H](OCc1ccccc1)C(=O)N[C@@H]1c2ccccc2C[C@H]1O |
|
GD039680 | -2.64 | 313.34 | C11H15O4N5S | C[n+]1cn([C@H]2O[C@H](CO)[C@H](O)[C@@H]2O)c2nc(N)nc([S-])c21 |
|
GD039681 | -3.68 | 479.54 | C15H25O7N7S2 | CSCC[C@@H](N)C(=O)NS(=O)(=O)OC[C@H]1O[C@H](N2C=NC3=C(N)NC=NC32)[C@H](O)[C@@H]1O |
|
GD039682 | -0.91 | 226.32 | C7H14O4S2 | CS[C@H]1O[C@H](CS)[C@H](O)[C@H](O)[C@@H]1O |
|
GD039683 | -16.28 | 1153.0 | C42H72O36 | OC[C@H]1O[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](CO)O[C@@H](O[C@@H]4[C@@H](CO)O[C@@H](O)[C@@H](O)[C@H]4O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@@H]2O)[C@H](O)[C@@H]1O |