active glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD028087 | -1.4 | 530.22 | C13H17O13N4P3 | C#C[C@@]1(c2ccc3c(N)ncnn23)O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@H](O)[C@H]1O |
|
GD010118 | 2.92 | 659.72 | C26H38O9N5PS2 | CC(C)(C)C(=O)SCCOP(=O)(OCCSC(=O)C(C)(C)C)OC[C@@H]1O[C@](C#N)(c2ccc3c(N)ncnn23)[C@H](O)[C@H]1O |
|
GD014495 | 3.42 | 648.74 | C26H41O9N4PS2 | CC(C)(C)C(=O)SCCOP(=O)(OCCSC(=O)C(C)(C)C)OC[C@@H]1O[C@@](C)(c2ccc3c(N)ncnn23)[C@H](O)[C@H]1O |
|
GD035183 | 3.58 | 660.75 | C27H41O9N4PS2 | C=C[C@@]1(c2ccc3c(N)ncnn23)O[C@H](COP(=O)(OCCSC(=O)C(C)(C)C)OCCSC(=O)C(C)(C)C)[C@H](O)[C@H]1O |
|
GD008439 | 3.03 | 658.74 | C27H39O9N4PS2 | C#C[C@@]1(c2ccc3c(N)ncnn23)O[C@H](COP(=O)(OCCSC(=O)C(C)(C)C)OCCSC(=O)C(C)(C)C)[C@H](O)[C@H]1O |
|
GD012576 | 3.32 | 604.73 | C30H52O12 | CCCCCCCCCCCCCCO[C@@H]1OC[C@H](O[C@@H]2OC[C@H](O)[C@H](OC(C)=O)[C@H]2OC(C)=O)[C@H](O)[C@H]1OC(C)=O |
|
GD025313 | -1.43 | 342.3 | C15H18O9 | CC(=O)Oc1ccccc1C(=O)O[C@@H]1[C@H](O)[C@H](O)O[C@H](CO)[C@H]1O |
|
GD022934 | -1.64 | 454.47 | C16H22O6N8S | NS(=O)(=O)OC[C@@H]1O[C@H](n2cnc3c(NCCCn4ccnc4)ncnc32)[C@H](O)[C@H]1O |
|
GD005327 | -0.24 | 462.49 | C19H22O6N6S | NS(=O)(=O)OC[C@@H]1O[C@H](n2cnc3c(N[C@@H]4CCc5ccccc54)ncnc32)[C@H](O)[C@H]1O |
|
GD022517 | -0.73 | 416.46 | C15H24O6N6S | CCCCCNc1ncnc2c1ncn2[C@@H]1O[C@H](COS(N)(=O)=O)[C@H](O)[C@H]1O |