synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD108057 | 1.68 | 560.35 | C22H26O11NBr | CC(=O)OC[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)C(=O)Nc1ccc(Br)cc1 |
|
GD106343 | -0.67 | 721.69 | C29H39O18NS | CC(=O)OC[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(=O)[C@@H]2CS[C@H]([C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H](COC(C)=O)OC(C)=O)N21 |
|
GD106344 | -0.67 | 721.69 | C29H39O18NS | CC(=O)OC[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(=O)[C@@H]2CS[C@H]([C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H](COC(C)=O)OC(C)=O)N12 |
|
GD113006 | 5.06 | 659.91 | C38H61O8N | CC(=O)N[C@H]1[C@H](O[C@H]2CC[C@@]3(C)[C@H](CC[C@]4(C)[C@@H]3CC=C3[C@H]5CC(C)(C)C[C@@H](C(=O)O)[C@@H]5CC[C@]34C)C2(C)C)O[C@H](CO)[C@@H](O)[C@@H]1O |
|
GD112276 | 4.03 | 675.9 | C38H61O9N | CC(=O)N[C@H]1[C@H](O[C@H]2CC[C@@]3(C)[C@H](CC[C@]4(C)[C@@H]3CC=C3[C@H]5CC(C)(C)C[C@@H](C(=O)O)[C@@H]5[C@H](O)C[C@]34C)C2(C)C)O[C@H](CO)[C@@H](O)[C@@H]1O |
|
GD107621 | 0.65 | 629.44 | C23H25O10N4SBr | CC(=O)OC[C@H]1O[C@@H](NC(=S)N/N=C2\C(=O)Nc3ccc(Br)cc32)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD106345 | -0.83 | 678.59 | C28H38O19 | CC(=O)OC[C@@H]1O[C@@H](O[C@H]2O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]2OC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD112689 | 4.84 | 582.49 | C29H21O8N2F3 | O=C(OC[C@H]1O[C@@H](c2nnc(C(F)(F)F)o2)[C@@H](OC(=O)c2ccccc2)[C@@H]1OC(=O)c1ccccc1)c1ccccc1 |
|
GD111715 | 3.65 | 589.64 | C33H35O9N | CC(=O)N[C@H]1[C@@H](OC(C)=O)O[C@H](COC(c2ccccc2)(c2ccccc2)c2ccccc2)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD113207 | 5.68 | 699.71 | C41H33O10N | O=C(N[C@H]1[C@@H](OC(=O)c2ccccc2)O[C@H](COC(=O)c2ccccc2)[C@@H](OC(=O)c2ccccc2)[C@@H]1OC(=O)c1ccccc1)c1ccccc1 |