active glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD014372 | 2.77 | 812.01 | C42H69O14N | C=CCO[C@@H]1[C@H](C)O[C@H](O[C@H]2[C@H](CC=O)C[C@@H](C)C(=O)C=CC(C)=C[C@@H](CO[C@@H]3O[C@H](C)[C@H](O)[C@H](OC)[C@H]3OC)[C@@H](CC)OC(=O)C[C@@H](O)[C@H]2C)[C@H](O)[C@H]1N(C)C |
|
GD012618 | -0.15 | 401.43 | C18H23O4N7 | C=CCCCn1cc(-c2nc(N)c3ncn([C@@H]4O[C@H](CO)[C@H](O)[C@H]4O)c3n2)cn1 |
|
GD017976 | -4.0 | 280.23 | C9H16O8N2 | COC(=O)N[C@@]1(C(N)=O)OC(CO)C(O)C(O)C1O |
|
GD012731 | 3.85 | 831.14 | C44H82O12N2 | CC[C@@H]1OC(=O)[C@H](C)[C@H](OC2CC(C)(OC)C(O)C(C)O2)[C@H](C)[C@H](OC2OC(C)CC(N(C)C)C2O)[C@@](C)(O)C[C@H](C)[C@H](N(C)C2CCCCC2)[C@H](C)[C@H](O)[C@]1(C)O |
|
GD018913 | -2.07 | 773.89 | C37H55O11N7 | CCn1c2ccccc2c2cc(NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)C(O)C(O)C(O)C(O)CO)ccc21 |
|
GD018667 | 4.39 | 888.24 | C47H89O12N3 | CC[C@@H]1OC(=O)[C@H](C)[C@H](OC2CC(C)(OC)C(O)C(C)O2)[C@H](C)[C@H](OC2OC(C)CC(N(C)C)C2O)[C@@](C)(O)C[C@H](C)[C@@H]2[C@H](C)[C@H](OCN2C(C)CCCN(CC)CC)[C@]1(C)O |
|
GD013469 | 2.98 | 724.7 | C38H36O8N2F4 | O=C(N[C@@H]1c2ccccc2C[C@H]1O)[C@@H](OCc1cccc(F)c1F)[C@@H](O)[C@@H](O)[C@@H](OCc1cccc(F)c1F)C(=O)NC1c2ccccc2C[C@H]1O |
|
GD008930 | -1.69 | 631.42 | C27H28O11N4Cl2 | CO[C@H]1[C@H](O)[C@@H](n2ccc(=O)[nH]c2=O)O[C@H]1[C@H](O[C@@H]1OC(C(=O)NCCc2ccc(Cl)cc2Cl)=C[C@H](O)[C@H]1O)C(N)=O |
|
GD027839 | -2.07 | 284.27 | C12H16O6N2 | O=c1ccn([C@@H]2O[C@H](CO)[C@](O)(C3CC3)[C@H]2O)c(=O)[nH]1 |
|
GD023344 | -2.85 | 268.22 | C11H12O6N2 | C#C[C@@]1(CO)O[C@H](n2ccc(=O)[nH]c2=O)[C@H](O)[C@H]1O |