synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD114073 | 5.45 | 636.65 | C37H32O10 | C=CCO[C@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1 |
|
GD109148 | 2.29 | 790.81 | C36H54O19 | CCC(=O)OC[C@H]1O[C@@H](O[C@H]2[C@H](OC(=O)CC)[C@@H](OC(=O)CC)[C@H](OC(=O)CC)O[C@@H]2COC(=O)CC)[C@H](OC(=O)CC)[C@@H](OC(=O)CC)[C@@H]1OC(=O)CC |
|
GD112664 | 4.72 | 673.73 | C38H35O7N5 | COc1ccc(C(OC[C@H]2O[C@@H](n3cnc4c(NC(=O)c5ccccc5)ncnc43)[C@H](O)[C@@H]2O)(c2ccccc2)c2ccc(OC)cc2)cc1 |
|
GD113996 | 5.38 | 802.89 | C42H53O9N5P | COc1ccc(C(OC[C@H]2O[C@@H](n3ccc(NC(C)=O)nc3=O)[C@@H](OC)[C@@H]2OP(OCCC#N)[NH+](C(C)C)C(C)C)(c2ccccc2)c2ccc(OC)cc2)cc1 |
|
GD113122 | 5.38 | 687.75 | C39H37O7N5 | COc1ccc(C(OC[C@H]2O[C@@H](n3cnc4c(NC(=O)c5ccccc5)ncnc43)[C@H](OC)[C@@H]2O)(c2ccccc2)c2ccc(OC)cc2)cc1 |
|
GD112337 | 4.01 | 669.74 | C36H39O8N5 | COc1ccc(C(OC[C@H]2O[C@@H](n3cnc4c(=O)[nH]c(NC(=O)C(C)C)nc43)[C@H](OC)[C@@H]2O)(c2ccccc2)c2ccc(OC)cc2)cc1 |
|
GD110810 | 3.44 | 686.5 | C31H31O8N2I | COc1ccc(C(OC[C@H]2O[C@@H](n3cc(I)c(=O)[nH]c3=O)[C@H](OC)[C@@H]2O)(c2ccccc2)c2ccc(OC)cc2)cc1 |
|
GD113123 | 5.68 | 699.71 | C41H33O10N | O=C(N[C@H]1[C@H](OC(=O)c2ccccc2)O[C@H](COC(=O)c2ccccc2)[C@@H](OC(=O)c2ccccc2)[C@@H]1OC(=O)c1ccccc1)c1ccccc1 |
|
GD105748 | -1.42 | 660.61 | C26H32O16N2S | CC(=O)OCC1=C(C(=O)O)N2C(=O)[C@@H](NC(=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H](COC(C)=O)OC(C)=O)[C@H]2SC1 |
|
GD105749 | -1.42 | 660.61 | C26H32O16N2S | CC(=O)OCC1=C(C(=O)O)N2C(=O)[C@@H](NC(=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H](COC(C)=O)OC(C)=O)[C@@H]2SC1 |