active glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD024552 | 0.14 | 467.47 | C21H23O10S | O=S(=O)([O-])O[C@@H]1[C@H](O)[C@H](Cc2cc(O)cc(C=Cc3ccc(O)cc3)c2)O[C@H](CO)[C@H]1O |
|
GD032835 | -0.04 | 450.44 | C22H26O10 | O=C(Cc1ccc(O)c(O)c1)O[C@H]1[C@H](OCCc2ccc(O)cc2)O[C@@H](CO)[C@@H](O)[C@H]1O |
|
GD014385 | 7.08 | 1405.58 | C68H108O30 | CCCCCCCCC[C@H](CCCCCCCC(C)=O)O[C@@H]1O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1O[C@@H]1O[C@H](CO[C@@H]2O[C@H](C)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]2OC(C)=O)[C@H](OCCC)[C@H](OC(=O)CCC)[C@H]1O[C@@H]1O[C@H](C)[C@H](OC(C)=O)[C@H](OC(C)=O)C1OC(C)=O |
|
GD004623 | 4.65 | 1063.29 | C55H86O18N2 | CCC(=O)O[C@@H]1CC(=O)O[C@H](C)C[C@H](O)[C@H](N(C)CCCc2ccccc2)C=C[C@H](OC(C)=O)[C@H](C)C[C@@H](CC=O)[C@H](O[C@H]2O[C@@H](C)[C@@H](O[C@@H]3C[C@](C)(OC(C)=O)[C@H](OC(=O)CC)[C@H](C)O3)[C@H](N(C)C)[C@H]2O)[C@@H]1OC |
|
GD020042 | -1.31 | 663.74 | C26H33O8N9S2 | CSCC[C@H](N)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NS(=O)(=O)OC[C@@H]1O[C@H](n2cnc3c(N)ncnc32)[C@H](O)[C@H]1O |
|
GD028351 | -2.04 | 603.62 | C24H29O8N9S | C[C@H](N)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NS(=O)(=O)OC[C@@H]1O[C@H](n2cnc3c(N)ncnc32)[C@H](O)[C@H]1O |
|
GD027252 | -1.63 | 629.66 | C26H31O8N9S | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COS(=O)(=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2CCCN2)[C@H](O)[C@H]1O |
|
GD028394 | -2.72 | 530.56 | C19H30O8N8S | CC(C)C[C@H](NC(=O)[C@H](C)N)C(=O)NS(=O)(=O)OC[C@@H]1O[C@H](n2cnc3c(N)ncnc32)[C@H](O)[C@H]1O |
|
GD017999 | -3.79 | 461.41 | C14H19O9N7S | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COS(=O)(=O)NC(=O)[C@H](N)CC(=O)O)[C@H](O)[C@H]1O |
|
GD025508 | -3.01 | 548.6 | C18H28O8N8S2 | CSCC[C@H](NC(=O)[C@H](C)N)C(=O)NS(=O)(=O)OC[C@@H]1O[C@H](n2cnc3c(N)ncnc32)[C@H](O)[C@H]1O |