synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD110197 | 2.69 | 626.57 | C31H30O14 | CC(=O)OC[C@@H]1O[C@H](Oc2ccc3c(=O)c(-c4ccc5c(c4)OCCO5)coc3c2)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD110196 | 2.92 | 568.53 | C29H28O12 | CC(=O)OC[C@@H]1O[C@H](Oc2ccc3c(=O)c(-c4ccccc4)coc3c2)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD111096 | 3.06 | 586.52 | C29H27O12F | CC(=O)OC[C@@H]1O[C@H](Oc2ccc3c(=O)c(-c4ccccc4F)coc3c2)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD071271 | -1.94 | 388.37 | C17H24O10 | COC(=O)C1=CO[C@H](O[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H]2[C@H](C)CC(=O)[C@@H]12 |
|
GD067901 | -0.22 | 373.37 | C17H19O5N5 | Cc1ccc(Nc2nc3c(=O)[nH]cnc3n2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1 |
|
GD106671 | -0.37 | 523.48 | C20H21O10N5S | CC(=O)O[C@H]1[C@H](OC(C)=O)CO[C@H](N2C(=O)/C(=N\NC(N)=S)c3ccc([N+](=O)[O-])cc32)[C@@H]1OC(C)=O |
|
GD106672 | -0.37 | 523.48 | C20H21O10N5S | CC(=O)O[C@H]1[C@@H](OC(C)=O)[C@H](OC(C)=O)CO[C@@H]1N1C(=O)/C(=N\NC(N)=S)c2ccc([N+](=O)[O-])cc21 |
|
GD100132 | 0.54 | 481.45 | C22H27O11N | COc1cc(C=O)ccc1O[C@@H]1O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1NC(C)=O |
|
GD109681 | 2.43 | 517.62 | C25H43O10N | CCCCCCCCCCO[C@@H]1O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@H](OCC(=O)OC)[C@@H]1NC(C)=O |
|
GD077593 | 0.87 | 380.44 | C19H28O6N2 | CC(C)=CCC/C(C)=C/COC[C@@H]1O[C@H](n2ccc(=O)[nH]c2=O)[C@H](O)[C@@H]1O |