active glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD039809 | -3.02 | 517.62 | C23H43O8N5 | CCN[C@@H]1C[C@@H](N)[C@@H](O[C@H]2OC(CN)=CC[C@@H]2NC(C)=O)[C@@H](O)[C@H]1O[C@H]1OC[C@@](C)(O)[C@H](NC)[C@@H]1O |
|
GD039810 | -13.75 | 1508.27 | C31H53O49N3S8 | CO[C@H]1O[C@H](COS(=O)(=O)O)[C@H](O[C@H]2O[C@H](C(=O)O)[C@H](O[C@H]3O[C@H](COS(=O)(=O)O)[C@H](O[C@H]4O[C@H](C(=O)O)[C@H](O[C@H]5O[C@H](COS(=O)(=O)O)[C@H](O)[C@H](O)[C@@H]5NS(=O)(=O)O)[C@H](O)[C@@H]4O)[C@H](OS(=O)(=O)O)[C@@H]3NS(=O)(=O)O)[C@H](O)[C@@H]2OS(=O)(=O)O)[C@H](O)[C@@H]1NS(=O)(=O)O |
|
GD039811 | -9.37 | 1661.42 | C36H60O55S9 | CO[C@@H]1[C@H](OS(=O)(=O)O)[C@H](O[C@H]2[C@H](C(=O)O)O[C@H](O[C@H]3[C@H](OS(=O)(=O)O)[C@H](OS(=O)(=O)O)[C@H](O[C@H]4[C@H](C(=O)O)O[C@H](O[C@H]5[C@H](OS(=O)(=O)O)[C@H](OS(=O)(=O)O)[C@H](OC)O[C@@H]5COS(=O)(=O)O)[C@H](OS(=O)(=O)O)[C@@H]4OC)O[C@@H]3COS(=O)(=O)O)[C@H](OC)[C@@H]2OC)O[C@H](COS(=O)(=O)O)[C@H]1OC |
|
GD039812 | -3.15 | 339.2 | C9H14O9N3P | Nc1cc(=O)[nH]c(=O)n1[C@H]1O[C@H](COP(=O)(O)O)[C@H](O)[C@@H]1O |
|
GD039813 | -0.93 | 414.42 | C19H22O5N6 | Nc1ccn([C@H]2O[C@H](CNC(=O)CCc3nc4ccccc4[nH]3)[C@@H](O)[C@H]2O)c(=O)n1 |
|
GD039814 | -2.23 | 294.27 | C11H14O4N6 | CNC(=O)[C@H]1O[C@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O |
|
GD039815 | -2.49 | 280.24 | C10H12O4N6 | NC(=O)[C@H]1O[C@H](n2cnc3c(N)ncnc32)[C@@H](O)[C@H]1O |
|
GD039816 | -2.1 | 363.38 | C15H21O4N7 | Nc1ncnc2c1ncn2[C@H]1O[C@H](C(=O)NC2CCNCC2)[C@H](O)[C@@H]1O |
|
GD039817 | -1.86 | 377.41 | C16H23O4N7 | Nc1ncnc2c1ncn2[C@H]1O[C@H](C(=O)NCC2CCNCC2)[C@H](O)[C@@H]1O |
|
GD039818 | -2.42 | 665.42 | C21H27O15N6P2 | Nc1ncnc2c1ncn2[C@H]1O[C@H](CO[P@@](=O)(O)O[P@@](=O)(O)OC[C@H]2O[C@H]([n+]3cccc(C(=O)O)c3)[C@@H](O)[C@H]2O)[C@@H](O)[C@H]1O |