synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD112877 | 4.69 | 596.62 | C31H24O7N4S | O=C(OC[C@@H]1O[C@@H](n2cnc3c(=S)[nH]cnc32)[C@@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1)c1ccccc1 |
|
GD112880 | 4.69 | 596.62 | C31H24O7N4S | O=C(OC[C@H]1O[C@@H](n2cnc3c(=S)[nH]cnc32)[C@@H](OC(=O)c2ccccc2)[C@@H]1OC(=O)c1ccccc1)c1ccccc1 |
|
GD112879 | 4.69 | 596.62 | C31H24O7N4S | O=C(OC[C@@H]1O[C@@H](n2cnc3c(=S)[nH]cnc32)[C@@H](OC(=O)c2ccccc2)[C@@H]1OC(=O)c1ccccc1)c1ccccc1 |
|
GD043899 | -1.56 | 252.23 | C10H12O4N4 | OC[C@@H]1O[C@H](n2cnc3cncnc32)[C@H](O)[C@@H]1O |
|
GD043960 | -1.56 | 252.23 | C10H12O4N4 | OC[C@@H]1O[C@@H](n2cnc3cncnc32)[C@H](O)[C@@H]1O |
|
GD043390 | -1.56 | 252.23 | C10H12O4N4 | OC[C@@H]1O[C@H](n2cnc3cncnc32)[C@@H](O)[C@@H]1O |
|
GD043393 | -1.56 | 252.23 | C10H12O4N4 | OC[C@@H]1O[C@@H](n2cnc3cncnc32)[C@@H](O)[C@@H]1O |
|
GD105546 | 3.36 | 464.58 | C28H34O5N | CO[C@H]1O[C@@H](COCc2ccccc2)[C@@H]([NH3+])[C@@H](OCc2ccccc2)[C@H]1OCc1ccccc1 |
|
GD105549 | 3.36 | 464.58 | C28H34O5N | CO[C@@H]1O[C@@H](COCc2ccccc2)[C@@H]([NH3+])[C@@H](OCc2ccccc2)[C@H]1OCc1ccccc1 |
|
GD105548 | 3.36 | 464.58 | C28H34O5N | CO[C@H]1O[C@@H](COCc2ccccc2)[C@@H]([NH3+])[C@@H](OCc2ccccc2)[C@@H]1OCc1ccccc1 |