active glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD024999 | 2.88 | 780.99 | C42H68O13 | CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@]5(C)CC[C@H](OC6OC(CO)C(O)C(O)C6OC6OC(CO)C(O)C(O)C6O)C(C)(C)[C@H]5CC[C@]43C)[C@H]2C1 |
|
GD013567 | -2.76 | 684.64 | C31H40O17 | COc1cc(C=CC(=O)OC[C@@]23O[C@H]2[C@H](OC2OC(C)C(O)C(O)C2O)C2C=CO[C@H](OC4OC(CO)C(O)C(O)C4O)C23)ccc1O |
|
GD004581 | 1.87 | 448.93 | C22H21O5N2ClS | N#Cc1c(-c2ccc(Cl)cc2)c2c(n(C3OC(CO)C(O)C(O)C3O)c1=S)CCC2 |
|
GD003836 | 5.33 | 653.11 | C33H29O9N2ClS | CC(=O)OCC1OC(n2c(-c3ccc(Cl)cc3)cc(-c3ccccc3)c(C#N)c2=S)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O |
|
GD006797 | -8.64 | 583.55 | C21H37O14N5 | Nc1ccn(C2OC(C(OC3OC(CO)C(O)C(N)C3O)C(O)C(O)C(O)C(O)CO)C(N)C(O)C2O)c(=O)n1 |
|
GD008368 | -0.31 | 541.54 | C21H27O10N5S | CSc1nc2c(nc(N)n2C2OC(COC(C)=O)C(OC(C)=O)C(OC(C)=O)C2OC(C)=O)c(=O)n1C |
|
GD024976 | -5.4 | 1651.82 | C70H131O36N6F | O=C(NCCCCCCNC(=O)n1cc(F)c(=O)[nH]c1=O)NCCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCCNC(=O)C(O)C(O)C(OC1OC(CO)C(O)C(O)C1O)C(O)CO |
|
GD010375 | 4.05 | 509.69 | C27H47O6N3 | CCCCCCCCCCCCCCCCCC(=O)Nc1ccn(C2OC(CO)C(O)C2O)c(=O)n1 |
|
GD022826 | -1.38 | 393.14 | C10H12O4N5I | Nc1ncnc2c1c(I)nn2C1OC(CO)C(O)C1O |
|
GD025181 | -0.55 | 270.24 | C11H14O6N2 | O=[N+]([O-])c1ccc(NC2OCC(O)C(O)C2O)cc1 |