active glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD039907 | -2.51 | 339.2 | C9H14O9N3P | NC(=O)c1[nH]nc([C@H]2O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]2O)c1O |
|
GD039908 | -2.97 | 738.55 | C20H24O13N10P2S2 | NC1=NC(=O)C2=N[C@@H]3C(S)=C(S)[C@@H](CO[P@@](=O)(O)O[P@@](=O)(O)OC[C@H]4O[C@H](n5cnc6c(=O)[nH]c(N)nc65)[C@@H](O)[C@H]4O)O[C@@H]3NC2=N1 |
|
GD039909 | -2.45 | 443.2 | C10H15O11N5P2 | Nc1nc2c(ncn2[C@H]2O[C@H](COP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H]2O)c(=O)[nH]1 |
|
GD039910 | -1.84 | 445.26 | C10H15O10N4P2S | O=P(O)(O)OC[C@H]1O[C@H](n2cnc3c(SP(=O)(O)O)[nH+]cnc32)[C@@H](O)[C@H]1O |
|
GD039911 | -3.08 | 482.38 | C16H27O11N4P | O=c1[nH]c(=O)c2c([nH]1)n(C[C@@H](O)[C@@H](O)[C@@H](O)CO)c(=O)n2CCCCCCOP(=O)(O)O |
|
GD039912 | 4.15 | 1005.96 | C37H66O17N7P3S | CCCCCCCCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)[C@@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O |
|
GD039913 | 0.79 | 1093.14 | C53H72O24 | CO[C@H]1C(O)=C(C(C)=O)C(=O)[C@]2(O[C@@H]3C[C@@H](O[C@@H]4C[C@@H](O[C@@H]5C[C@](C)(O)[C@@H](O)[C@@H](C)O5)[C@@H](O)[C@@H](C)O4)[C@@H](O)[C@@H](C)O3)C(=O)c3c(cc4cc(O[C@@H]5C[C@@H](O[C@@H]6C[C@@H](O)[C@@H](O)[C@@H](C)O6)[C@@H](O)[C@@H](C)O5)c(C)c(O)c4c3O)C[C@H]12 |
|
GD039914 | -0.23 | 360.26 | C13H17O8N2P | COc1ccc2c(c1)ncn2[C@H]1O[C@H](COP(=O)(O)O)[C@H](O)[C@@H]1O |
|
GD039915 | -2.89 | 604.4 | C18H30O15N4P2 | CC(C)(COP(=O)(O)O)[C@@H](O)C(=O)NCCC(=O)O[P@](=O)(O)OC[C@H]1O[C@H](n2ccc(N)nc2=O)[C@H](O)[C@@H]1O |
|
GD037682 | -1.23 | 301.25 | C12H15O8N | O=[N+]([O-])c1ccc(O[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@@H]2O)cc1 |