active glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD039839 | -3.88 | 760.42 | C21H29O18N7P3 | NC(=O)C1C=[N+]([C@H]2O[C@H](CO[P@@](=O)(O)O[P@@](=O)(O)OC[C@H]3O[C@H](n4cnc5c(N)ncnc54)[C@@H](OP(=O)(O)O)[C@H]3O)[C@@H](O)[C@H]2O)C=CC1=O |
|
GD039840 | 4.89 | 1076.05 | C41H72O18N7P3S | CCCCCCCCCCCCCCCCCC(=O)CC(=O)SCCNC(=O)CCNC(=O)[C@@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O |
|
GD039841 | 1.6 | 448.53 | C20H32O9S | CCCCCCCCc1ccc(O[C@H]2O[C@H](COS(=O)(=O)O)[C@H](O)[C@H](O)[C@@H]2O)cc1 |
|
GD038655 | -2.18 | 208.21 | C8H16O6 | CCO[C@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@@H]1O |
|
GD039842 | 3.92 | 1003.94 | C37H64O17N7P3S | CCCCCCC=CCCCCCCCC(=O)SCCNC(=O)CCNC(=O)[C@@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O |
|
GD039843 | -3.62 | 370.14 | C7H16O13P2 | O=P(O)(O)OC[C@@H](O)[C@H]1O[C@](O)(COP(=O)(O)O)[C@H](O)[C@@H]1O |
|
GD039844 | -1.85 | 433.5 | C19H35O8N3 | CCC(=O)NCCCNC(=O)CCCCO[C@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@@H]1NC(C)=O |
|
GD039845 | -3.15 | 454.29 | C13H19O12N4P | Nc1c(C(=O)N[C@H](CC(=O)O)C(=O)O)ncn1[C@H]1O[C@H](COP(=O)(O)O)[C@H](O)[C@@H]1O |
|
GD038180 | -0.85 | 353.29 | C10H16O7N3PS | CO[C@@H]1[C@@H](O)[C@@H](COP(=O)(O)S)O[C@H]1n1ccc(N)nc1=O |
|
GD039846 | -1.14 | 354.28 | C10H15O8N2PS | CO[C@@H]1[C@@H](O)[C@@H](COP(=O)(O)S)O[C@H]1n1ccc(=O)[nH]c1=O |