synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD110920 | 3.32 | 598.61 | C30H34O11N2 | CO[C@@H]1[C@@H](OC(N)=O)[C@H](O)[C@H](Oc2ccc3c(O)c(NC(=O)c4ccc(O)c(CC=C(C)C)c4)c(=O)oc3c2)OC1(C)C |
|
GD093725 | -7.53 | 482.64 | C21H48O7N5 | C[NH2+][C@H](C)[C@H]1CC[C@@H]([NH3+])[C@@H](O[C@H]2[C@@H]([NH3+])C[C@@H]([NH3+])[C@H](O[C@H]3OC[C@](C)(O)[C@H]([NH2+]C)[C@H]3O)[C@H]2O)O1 |
|
GD093726 | -7.53 | 482.64 | C21H48O7N5 | C[NH2+][C@H](C)[C@H]1CC[C@@H]([NH3+])[C@@H](O[C@@H]2[C@@H]([NH3+])C[C@@H]([NH3+])[C@H](O[C@@H]3OC[C@](C)(O)[C@H]([NH2+]C)[C@H]3O)[C@H]2O)O1 |
|
GD093727 | -7.53 | 482.64 | C21H48O7N5 | C[NH2+][C@H](C)[C@H]1CC[C@@H]([NH3+])[C@@H](O[C@H]2[C@@H]([NH3+])C[C@@H]([NH3+])[C@H](O[C@@H]3OC[C@](C)(O)[C@H]([NH2+]C)[C@H]3O)[C@H]2O)O1 |
|
GD041286 | -3.38 | 180.16 | C6H12O6 | O=C[C@H](O)[C@@H](O)[C@@H](O)[C@@H](O)CO |
|
GD041101 | -3.17 | 178.14 | C6H10O6 | O=CC(=O)[C@@H](O)[C@@H](O)[C@H](O)CO |
|
GD113652 | 7.59 | 540.73 | C34H36O4S | Cc1ccc(S[C@H]2O[C@@H](C)[C@@H](OCc3ccccc3)[C@@H](OCc3ccccc3)[C@@H]2OCc2ccccc2)cc1 |
|
GD113651 | 7.59 | 540.73 | C34H36O4S | Cc1ccc(S[C@@H]2O[C@@H](C)[C@@H](OCc3ccccc3)[C@@H](OCc3ccccc3)[C@@H]2OCc2ccccc2)cc1 |
|
GD109134 | 2.19 | 575.41 | C26H27O8N2Br | COc1ccccc1NC(=O)c1cc2cc(Br)ccc2cc1O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1NC(C)=O |
|
GD005501 | -2.14 | 281.27 | C11H15O4N5 | Cn1cnc2c(ncn2[C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)c1=N |