active glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD012033 | -1.94 | 705.85 | C32H59O12N5 | COC(=O)[C@H](CC(C)C)NC(=O)[C@H](NC(=O)CCOC[C@@H]1O[C@H](OCCCNC(=O)[C@H](NC(=O)[C@H](C)N)C(C)C)[C@H](O)[C@H](O)[C@H]1O)C(C)C |
|
GD024156 | 0.94 | 918.05 | C42H71O17N5 | COC(=O)[C@H](CC(C)C)NC(=O)[C@H](NC(=O)CCOC[C@@H]1O[C@H](OCCNC(=O)[C@H](NC(=O)[C@H](C)NC(=O)OC(C)(C)C)C(C)C)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O)C(C)C |
|
GD027558 | 1.33 | 932.08 | C43H73O17N5 | COC(=O)[C@H](CC(C)C)NC(=O)[C@H](NC(=O)CCOC[C@@H]1O[C@H](OCCCNC(=O)[C@H](NC(=O)[C@H](C)NC(=O)OC(C)(C)C)C(C)C)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O)C(C)C |
|
GD029594 | 5.91 | 1062.31 | C57H83O14N5 | COC(=O)[C@H](CC(C)C)NC(=O)[C@H](NC(=O)CCOC[C@@H]1O[C@H](OCCNC(=O)[C@H](NC(=O)[C@H](C)NC(=O)OC(C)(C)C)C(C)C)[C@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1)C(C)C |
|
GD015759 | 6.3 | 1076.34 | C58H85O14N5 | COC(=O)[C@H](CC(C)C)NC(=O)[C@H](NC(=O)CCOC[C@@H]1O[C@H](OCCCNC(=O)[C@H](NC(=O)[C@H](C)NC(=O)OC(C)(C)C)C(C)C)[C@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1)C(C)C |
|
GD015617 | 4.71 | 748.91 | C42H56O10N2 | COC(=O)[C@H](CC(C)C)NC(=O)[C@H](NC(=O)CCOC[C@@H]1OC(O)[C@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1)C(C)C |
|
GD034581 | -1.96 | 478.54 | C21H38O10N2 | COC(=O)[C@H](CC(C)C)NC(=O)[C@H](NC(=O)CCOC[C@@H]1OC(O)[C@H](O)[C@H](O)[C@H]1O)C(C)C |
|
GD020017 | -3.24 | 419.29 | C13H18O9N5P | CCCn1c(=O)n(C2OC(COP(=O)([O-])[O-])[C@H](O)[C@H]2O)c2nc(N)nc(O)c21 |
|
GD005591 | 2.89 | 645.68 | C31H35O12NS | CC(=O)OC[C@@H]1O[C@H](CC(=O)C=Cc2cccc(NS(=O)(=O)c3ccc(C)cc3)c2)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD005591 | 2.89 | 645.68 | C31H35O12NS | CC(=O)OC[C@@H]1O[C@H](CC(=O)C=Cc2cccc(NS(=O)(=O)c3ccc(C)cc3)c2)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O |