synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD071078 | -1.59 | 390.39 | C17H26O10 | CO[C@H]1C[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]2[C@H]1C |
|
GD112077 | 3.84 | 662.86 | C37H58O10 | CC(=O)O[C@H]1[C@@H]2O[C@@]3(C(C)(C)O)CC[C@](C)(O3)[C@@H]2[C@@]2(C)CC[C@@]34C[C@@]35CC[C@H](O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)C(C)(C)[C@@H]5CC[C@H]4[C@]12C |
|
GD112076 | 3.84 | 662.86 | C37H58O10 | CC(=O)O[C@H]1[C@@H]2O[C@@]3(C(C)(C)O)CC[C@](C)(O3)[C@@H]2[C@@]2(C)CC[C@@]34C[C@@]35CC[C@H](O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)C(C)(C)[C@@H]5CC[C@@H]4[C@]12C |
|
GD111255 | 3.47 | 664.88 | C37H60O10 | CC(=O)O[C@H]1[C@H](O)[C@H]([C@]2(C)CC[C@H](C(C)(C)O)O2)[C@@]2(C)CC[C@@]34C[C@@]35CC[C@H](O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)C(C)(C)[C@@H]5CC[C@H]4[C@]12C |
|
GD111254 | 3.47 | 664.88 | C37H60O10 | CC(=O)O[C@H]1[C@H](O)[C@H]([C@]2(C)CC[C@H](C(C)(C)O)O2)[C@@]2(C)CC[C@@]34C[C@@]35CC[C@H](O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)C(C)(C)[C@@H]5CC[C@@H]4[C@]12C |
|
GD111714 | 3.53 | 502.59 | C28H26O5N2S | O=c1ccn([C@@H]2O[C@H](COC(c3ccccc3)(c3ccccc3)c3ccccc3)[C@H](O)[C@@H]2O)c(=S)[nH]1 |
|
GD112075 | 3.53 | 502.59 | C28H26O5N2S | O=c1ccn([C@@H]2O[C@@H](COC(c3ccccc3)(c3ccccc3)c3ccccc3)[C@H](O)[C@@H]2O)c(=S)[nH]1 |
|
GD111713 | 3.53 | 502.59 | C28H26O5N2S | O=c1ccn([C@@H]2O[C@H](COC(c3ccccc3)(c3ccccc3)c3ccccc3)[C@@H](O)[C@@H]2O)c(=S)[nH]1 |
|
GD112074 | 3.53 | 502.59 | C28H26O5N2S | O=c1ccn([C@@H]2O[C@@H](COC(c3ccccc3)(c3ccccc3)c3ccccc3)[C@@H](O)[C@@H]2O)c(=S)[nH]1 |
|
GD046833 | -2.31 | 313.31 | C13H19O6N3 | O=c1nc(N2CCOCC2)ccn1[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |