active glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD024963 | 0.27 | 357.29 | C18H13O8 | O=C(OC(C(=O)[O-])C(OC(=O)c1ccccc1)C(=O)O)c1ccccc1 |
|
GD013646 | 0.85 | 855.03 | C44H70O16 | CC1OC(OC2C(O[C@@H]3CC[C@]4(C)C(=CC[C@@H]5[C@@H]6C[C@@H]7O[C@]8(CC[C@H](C)CO8)[C@H](C)[C@H]7[C@@]6(C)CC[C@H]54)C3)OC(CO)C(OC3OC(CO)C(O)C3O)C2O)C(O)C(O)C1O |
|
GD003054 | 0.34 | 514.41 | C17H19O9N6PS | Nc1nc(SCc2ccc([N+](=O)[O-])cc2)nc2c1ncn2C1OC(COP(=O)(O)O)C(O)C1O |
|
GD018500 | 9.9 | 867.15 | C45H87O13P | CCCCCCCCCCCCCCCCCC(=O)OCC(COC1OC(COP(=O)(O)O)C(O)C(O)C1O)OC(=O)CCCCCCCCCCCCCCCCC |
|
GD030806 | 2.84 | 628.03 | C31H30O10N3Cl | CC(=O)OCC1OC(N2C(=O)C(=Cc3ccc(Cl)cc3)C(N)=Nc3ccccc32)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O |
|
GD016505 | 4.89 | 690.73 | C35H34O11N2S | COc1ccc(-c2c(C(C)=O)c(-c3ccccc3)n(C3OC(COC(C)=O)C(OC(C)=O)C(OC(C)=O)C3OC(C)=O)c(=S)c2C#N)cc1 |
|
GD009525 | 4.21 | 752.98 | C41H68O12 | COC(C)(C)[C@H](O)[C@H](O)C[C@H](C)C1=C2CC[C@@H]3[C@]4(C)CC[C@H](OC(C)=O)C(C)(C)[C@H]4C[C@H](OC4OC(COC(C)=O)C(O)C(O)C4O)[C@@]3(C)[C@@]2(C)CC1 |
|
GD001554 | -0.8 | 317.35 | C10H11O5N3S2 | O=c1[nH]c(=S)[nH]c2c(C3OC(CO)C(O)C3O)nsc12 |
|
GD028414 | 2.02 | 435.27 | C21H16O4N4Cl2 | OCC(O)C(O)C(O)c1nn(-c2ccccc2)c2nc3cc(Cl)c(Cl)cc3nc12 |
|
GD023311 | -0.54 | 476.48 | C24H28O10 | O=C(C=Cc1ccccc1)OCC1=C[C@H](O)[C@@H]2C=CO[C@H](OC3OC(CO)C(O)C(O)C3O)[C@H]12 |