active glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD030571 | -1.17 | 364.25 | C13H19O6NCl2S | CSC1OC(C(NC(=O)C(Cl)Cl)C(C)O)C(O)C(O)C1O |
|
GD004728 | -0.85 | 598.54 | C23H26O13N4S | COC(=O)[C@@H]1O[C@H](n2cc(COC(=O)c3ccc(S(N)(=O)=O)cc3)nn2)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD003319 | -2.26 | 458.45 | C17H22O9N4S | CO[C@@H]1O[C@H](Cn2cc(COC(=O)c3ccc(S(N)(=O)=O)cc3)nn2)[C@H](O)[C@H](O)[C@H]1O |
|
GD013473 | 7.75 | 993.72 | C54H85O13N2Cl | CCC(C)N(CC1CC1)[C@@H]1C[C@H](C)OC(O[C@@H]2[C@H](C)[C@H](OC3C[C@@](C)(OC)[C@H](O)[C@H](C)O3)[C@H](C)C(=O)O[C@H](CC)[C@]3(C)OC(=O)N(CCc4ccc(Cl)cc4)[C@H]3[C@H](C)C(=O)[C@H](C)C[C@]2(C)OC)[C@H]1O |
|
GD017844 | 1.68 | 1067.24 | C48H86O20N6 | CC(C)(C)OC(=O)NCC1OC(OC2C(NC(=O)OC(C)(C)C)CC(NC(=O)OC(C)(C)C)C(OC3OC(CNC(=O)C(C)(C)C)C(O)C(NC(=O)OC(C)(C)C)C3O)C2O)C(NC(=O)OC(C)(C)C)C(O)C1O |
|
GD018698 | 3.72 | 1137.37 | C53H96O20N6 | CCCCCC(=O)N(CCCC)CC1OC(OC2C(NC(=O)OC(C)(C)C)CC(NC(=O)OC(C)(C)C)C(OC3OC(CNC(=O)OC(C)(C)C)C(O)C(O)C3NC(=O)OC(C)(C)C)C2O)C(O)C(NC(=O)OC(C)(C)C)C1O |
|
GD009362 | -2.56 | 472.43 | C17H20O10N4S | COC(=O)[C@@H]1O[C@H](n2cc(COC(=O)c3ccc(S(N)(=O)=O)cc3)nn2)[C@H](O)[C@H](O)[C@H]1O |
|
GD004420 | -2.11 | 414.4 | C15H18O8N4S | NS(=O)(=O)c1ccc(C(=O)OCc2cn([C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)nn2)cc1 |
|
GD022373 | 2.59 | 1060.2 | C49H81O20N5 | CC(C)(C)OC(=O)NCC1OC(OC2C(NC(=O)OC(C)(C)C)CC(NC(=O)OC(C)(C)C)C(OC3OC(COc4ccccc4)C(O)C(NC(=O)OC(C)(C)C)C3O)C2O)C(NC(=O)OC(C)(C)C)C(O)C1O |
|
GD001304 | -1.35 | 413.33 | C15H20O7N5P | O=P([O-])([O-])OC[C@@H]1O[C@H](n2cnc3c(NC4CCCC4)ncnc32)[C@H](O)[C@H]1O |