active glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD032117 | 3.58 | 724.76 | C37H44O13N2 | COC(=O)[C@@H]1CC[C@H](C)[C@H](c2ccc(C)cc2)N1C(=O)c1ccc(C=NO[C@@H]2O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]2OC(C)=O)cc1 |
|
GD018728 | 2.93 | 598.56 | C30H30O13 | COc1ccc(-c2coc3ccc(OC4OC(COC(C)=O)C(OC(C)=O)C(OC(C)=O)C4OC(C)=O)cc3c2=O)cc1 |
|
GD004824 | -0.61 | 399.41 | C18H21O4N7 | CNC(=O)[C@@H]1O[C@H](n2cnc3c(NCc4ccc(N)cc4)ncnc32)[C@H](O)[C@H]1O |
|
GD009914 | -2.24 | 376.36 | C16H24O10 | C[C@@H]1[C@H](O)C[C@@H]2C(C(=O)O)=CO[C@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H]21 |
|
GD003060 | -1.1 | 862.75 | C42H38O20 | O=C(O)c1cc(O)c2c(c1)[C@@H]([C@H]1c3cc(C(=O)O)cc(O)c3C(=O)c3c(OC4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cccc31)c1cccc(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)c1C2=O |
|
GD020576 | -0.26 | 321.12 | C12H10O4N4Cl2 | OCC1OC(n2cnc3c(Cl)nc(Cl)nc32)C(O)C1O |
|
GD003156 | 0.45 | 369.81 | C16H20O4N5Cl | OC[C@@H]1O[C@H](n2cnc3c(NC4CCCC4)nc(Cl)nc32)[C@H](O)[C@H]1O |
|
GD000544 | 1.91 | 687.87 | C35H61O12N | CO[C@@H]1C[C@H](O[C@@H]2[C@H](C)C(=O)O[C@H](C)[C@H](C)[C@H](O)[C@H](C)C(=O)[C@]3(CO3)C[C@H](C)[C@H](O[C@@H]3O[C@H](C)C[C@H](N(C)C)[C@H]3O)[C@H]2C)O[C@H](C)[C@H]1O |
|
GD000972 | -1.51 | 584.66 | C29H44O12 | C[C@@H]1O[C@H](O[C@@H]2C[C@H](O)[C@]3(CO)[C@H]4[C@H](CC[C@@]3(O)C2)[C@]2(O)CC[C@@H](C3=CC(=O)OC3)[C@@]2(C)C[C@H]4O)[C@H](O)[C@H](O)[C@H]1O |
|
GD017775 | -1.04 | 308.26 | C10H12O4N8 | [N-]=[N+]=Nc1nc2c(N)ncnc2n1C1OC(CO)C(O)C1O |