active glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD025338 | 3.92 | 878.16 | C47H79O12N3 | CC[C@@H]1OC(=O)[C@H](C)[C@H](O[C@@H]2C[C@@](C)(OC)[C@](O)(c3cc4ccccc4n3C)[C@H](C)O2)[C@H](C)[C@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C)[C@H]2O)[C@@](C)(O)C[C@H](C)CN(C)[C@H](C)[C@H](O)[C@]1(C)O |
|
GD002190 | 2.77 | 757.0 | C40H70O12N | C#CC[N+](C)(C)C1CC(C)OC(O[C@@H]2C(C)C(OC3CC(C)(OC)C(O)C(C)O3)C(C)C(=O)OC(CC)[C@@](C)(O)[C@H](O)[C@H](C)C3O[C@@]2(C)C[C@H]3C)C1O |
|
GD011131 | 1.08 | 847.88 | C41H49O13N7 | CC(=O)N[C@@H]1[C@H](OC(C)C(=O)N[C@H](C)C(=O)N[C@H](CCC(=O)OCCNc2c3ccccc3nc3cccc([N+](=O)[O-])c23)C(N)=O)C(O)C(CO)O[C@H]1OCc1ccccc1 |
|
GD016915 | 0.78 | 518.47 | C25H26O12 | CO[C@@H]1O[C@H](COC(=O)C=Cc2ccc(O)c(O)c2)[C@H](O)[C@H](OC(=O)C=Cc2ccc(O)c(O)c2)[C@H]1O |
|
GD005566 | -3.98 | 449.55 | C19H39O7N5 | CNC1C(O)C(OC2C(N)CC(N)C(OC3OC(CN)CCC3N)C2O)OCC1(C)O |
|
GD021936 | 1.95 | 773.02 | C40H72O12N2 | CC#C[C@@]1(O)[C@H](C)O[C@H](O[C@H]2[C@H](C)C(=O)O[C@@H](CC)[C@](C)(O)[C@@H](O)[C@@H](C)NC[C@@H](C)C[C@](C)(O)[C@@H](O[C@@H]3O[C@H](C)C[C@H](N(C)C)[C@H]3O)[C@H]2C)C[C@]1(C)OC |
|
GD028363 | -4.42 | 263.25 | C8H17O5N5 | N=C(N)N=C(N)NCC1OC(O)[C@H](O)C(O)C1O |
|
GD019110 | -1.34 | 293.28 | C12H15O4N5 | C=Cc1nc2c(N)ncnc2n1[C@@H]1O[C@H](CO)[C@H](O)[C@H]1O |
|
GD018982 | 3.58 | 864.13 | C46H77O12N3 | CC[C@@H]1OC(=O)[C@H](C)[C@H](O[C@@H]2C[C@@](C)(OC)[C@](O)(c3cc4ccccc4n3C)[C@H](C)O2)[C@H](C)[C@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C)[C@H]2O)[C@@](C)(O)C[C@H](C)CN[C@H](C)[C@H](O)[C@]1(C)O |
|
GD028343 | 1.32 | 432.97 | C20H29O5N2ClS | CCCCc1ccnc(C(=O)NC(C(C)Cl)C2OC(SC)C(O)C(O)C2O)c1 |