active glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD016317 | -1.87 | 636.63 | C19H28O16N2S3 | CO[C@@H]1O[C@H](CNC(=O)CN(CCc2ccccc2)C(C)=O)[C@H](OS(=O)(=O)O)[C@H](OS(=O)(=O)O)[C@H]1OS(=O)(=O)O |
|
GD008243 | -3.28 | 756.71 | C18H32O22N2S4 | CCN(CC(=O)NCCO[C@@H]1O[C@H](COS(=O)(=O)O)[C@H](OS(=O)(=O)O)[C@H](OS(=O)(=O)O)[C@H]1OS(=O)(=O)O)C(=O)CCCCC(=O)O |
|
GD008020 | -1.98 | 878.9 | C22H42O24N2S5 | CCN(CC(=O)NCCO[C@@H]1O[C@H](COS(=O)(=O)O)[C@H](OS(=O)(=O)O)[C@H](OS(=O)(=O)O)[C@H]1OS(=O)(=O)O)C(=O)CCCCCCCCCOS(=O)(=O)O |
|
GD013479 | -1.09 | 664.69 | C21H32O16N2S3 | CCN(CC(=O)NC[C@@H]1O[C@H](OC)[C@H](OS(=O)(=O)O)[C@H](OS(=O)(=O)O)[C@H]1OS(=O)(=O)O)C(=O)CCCc1ccccc1 |
|
GD017102 | -2.72 | 718.67 | C18H26O20N2S4 | CC(=O)N(CC(=O)NCCO[C@@H]1O[C@H](COS(=O)(=O)O)[C@H](OS(=O)(=O)O)[C@H](OS(=O)(=O)O)[C@H]1OS(=O)(=O)O)c1ccccc1 |
|
GD014960 | -2.72 | 732.7 | C19H28O20N2S4 | CC(=O)N(CC(=O)NCCO[C@@H]1O[C@H](COS(=O)(=O)O)[C@H](OS(=O)(=O)O)[C@H](OS(=O)(=O)O)[C@H]1OS(=O)(=O)O)Cc1ccccc1 |
|
GD017326 | -2.68 | 746.72 | C20H30O20N2S4 | CC(=O)N(CCc1ccccc1)CC(=O)NCCO[C@@H]1O[C@H](COS(=O)(=O)O)[C@H](OS(=O)(=O)O)[C@H](OS(=O)(=O)O)[C@H]1OS(=O)(=O)O |
|
GD010416 | -2.8 | 596.45 | C20H25O10N10P | Nc1ncnc2c1ncn2[C@H]1O[C@@H](COP(=O)(O)OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O |
|
GD003968 | -2.8 | 596.45 | C20H25O10N10P | Nc1ncnc2c1ncn2[C@@H]1O[C@@H](CO)[C@H](OP(=O)(O)O[C@H]2[C@@H](CO)O[C@@H](n3cnc4c(N)ncnc43)[C@@H]2O)[C@@H]1O |
|
GD002462 | 1.7 | 395.44 | C22H23O5N2 | Cc1c2cc[n+]([C@@H]3O[C@H](CO)[C@H](O)[C@H]3O)cc2c(C)c2c1[nH]c1ccc(O)cc12 |