synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD109527 | 2.21 | 532.57 | C25H28O9N2S | CC(=O)OC[C@H]1O[C@@H](NC(=S)Nc2cccc3ccccc23)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD109526 | 2.21 | 532.57 | C25H28O9N2S | CC(=O)OC[C@@H]1O[C@@H](NC(=S)Nc2cccc3ccccc23)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD003960 | 0.39 | 424.99 | C19H33O5N2ClS | CCC[C@@H]1C[C@H](C(=O)N[C@H]([C@H](C)Cl)[C@@H]2O[C@H](SC)[C@H](O)[C@H](O)[C@H]2O)N(C)C1 |
|
GD046824 | -1.55 | 314.36 | C13H18O5N2S | OC[C@H](O)[C@H](O)[C@H](O)[C@@]1(CO)NN=C(c2ccccc2)S1 |
|
GD092944 | 1.13 | 449.46 | C22H27O9N | CC(=O)OC[C@@H]1O[C@H](N2CCc3ccccc32)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD107490 | 0.21 | 529.53 | C23H23O8N5S | Cc1cc2nc3c(=O)n(Sc4ccc([N+](=O)[O-])cc4)c(=O)nc-3n(C[C@H](O)[C@H](O)[C@H](O)CO)c2cc1C |
|
GD107493 | 0.21 | 529.53 | C23H23O8N5S | Cc1cc2nc3c(=O)n(Sc4ccc([N+](=O)[O-])cc4)c(=O)nc-3n(C[C@@H](O)[C@H](O)[C@H](O)CO)c2cc1C |
|
GD107492 | 0.21 | 529.53 | C23H23O8N5S | Cc1cc2nc3c(=O)n(Sc4ccc([N+](=O)[O-])cc4)c(=O)nc-3n(C[C@H](O)[C@@H](O)[C@H](O)CO)c2cc1C |
|
GD107491 | 0.21 | 529.53 | C23H23O8N5S | Cc1cc2nc3c(=O)n(Sc4ccc([N+](=O)[O-])cc4)c(=O)nc-3n(C[C@@H](O)[C@@H](O)[C@H](O)CO)c2cc1C |
|
GD110457 | 2.53 | 577.63 | C26H27O10NS2 | CC(=O)OC[C@H]1O[C@@H](N2C(=O)/C(=C\C=C\c3ccccc3)SC2=S)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O |