active glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD004654 | 0.35 | 348.38 | C15H16O4N4S | Nc1ncnc2c1c(-c1cccs1)cn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1O |
|
GD004413 | 0.35 | 348.38 | C15H16O4N4S | Nc1ncnc2c1c(-c1ccsc1)cn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1O |
|
GD000585 | -1.39 | 290.28 | C13H14O4N4 | C#Cc1cn([C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)c2ncnc(N)c12 |
|
GD025744 | -0.2 | 1020.79 | C37H49O14N4F13 | CC(C)(C)[N+]([O-])=Cc1ccc(CNC(=O)CC(NC(=O)[C@H](O)[C@H](O)[C@H](C[C@H](O)CO)O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)C(=O)NCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)cc1 |
|
GD019498 | 3.16 | 860.69 | C41H32O21 | O=C(OC[C@@H]1O[C@H](OC(=O)c2cc(O)cc(O)c2)[C@H](OC(=O)c2cc(O)cc(O)c2)[C@H](OC(=O)c2cc(O)cc(O)c2)[C@H]1OC(=O)c1cc(O)cc(O)c1)c1cc(O)cc(O)c1 |
|
GD023760 | -3.68 | 439.49 | C11H21O11NS3 | C[S+]([O-])CCC(C(=O)NOS(=O)(=O)O)[C@]1(S)O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O |
|
GD002857 | 0.17 | 583.66 | C21H29O12NS3 | C[S+]([O-])CCCCC(=NOS(=O)(=O)O)S[C@@H]1O[C@H](COC(=O)C=Cc2ccc(O)cc2)[C@H](O)[C@H](O)[C@H]1O |
|
GD004388 | 1.69 | 940.68 | C41H32O26 | O=C(OC[C@@H]1O[C@H](OC(=O)c2cc(O)c(O)c(O)c2)[C@H](OC(=O)c2cc(O)c(O)c(O)c2)[C@H](OC(=O)c2cc(O)c(O)c(O)c2)[C@H]1OC(=O)c1cc(O)c(O)c(O)c1)c1cc(O)c(O)c(O)c1 |
|
GD002252 | -3.13 | 642.4 | C21H28O17N2P2 | O=c1[nH]c(=O)n([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)cc1-c1ccccc1 |
|
GD024564 | -3.53 | 632.36 | C19H26O18N2P2 | O=c1[nH]c(=O)n([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)cc1-c1ccco1 |