active glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD040520 | -2.72 | 246.22 | C9H14O6N2 | O=C1N[C@@H](O)C=CN1C1O[C@H](CO)[C@H](O)[C@@H]1O |
|
GD037889 | -3.22 | 180.16 | C6H12O6 | OC[C@H]1O[C@H](O)[C@H](O)[C@H](O)[C@@H]1O |
|
GD038501 | -2.57 | 194.18 | C7H14O6 | CO[C@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@@H]1O |
|
GD040521 | -0.77 | 558.47 | C19H23O10N6PS | Cc1c(O)nc(CC(=O)S)c(C)c1OP(=O)(O)OC[C@H]1O[C@H](n2cnc3c(=O)[nH]c(N)nc32)[C@H](O)[C@@H]1O |
|
GD040522 | 0.32 | 390.39 | C20H22O8 | COC(=O)c1cccc(-c2ccc(O[C@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@@H]3O)cc2)c1 |
|
GD040523 | 3.59 | 1129.38 | C58H96O21 | COC[C@@H](C[C@H]1O[C@](O)([C@H](O)[C@H]2C[C@@H](OC)[C@@H](O)CCC=C(C)C=C[C@@H](O[C@H]3O[C@H](C)[C@H](OC)[C@H](O)[C@@H]3O)[C@H](C)C=C(C)C=C(C)C=C(C)C(=O)O2)[C@@H](C)[C@@H](O)[C@H]1C)O[C@@H]1C[C@](C)(O)[C@@H](O[C@@H]2C[C@@H](OC)[C@@H](O)[C@@H](C)O2)[C@@H](C)O1 |
|
GD040524 | 3.22 | 1157.39 | C59H96O22 | COCCC[C@H]1O[C@](O)([C@@H](C)[C@H]2C[C@@H](OC)[C@@H](O)C=C(C)C=C(C)C=C(C)[C@@H](O[C@H]3O[C@H](C)[C@H](O)[C@H](O)[C@@H]3O)[C@H](C)C=C(C)C=C(OC)C=C(C)C(=O)O2)[C@@H](OC)[C@@H](O)[C@]1(C)O[C@@H]1C[C@@H](O)[C@@H](O[C@@H]2C[C@](C)(O)[C@@H](O)[C@@H](C)O2)[C@@H](C)O1 |
|
GD040525 | -3.02 | 768.53 | C27H30O15N8P2 | NC(=O)c1c[n+]([C@H]2O[C@H](COP(=O)([O-])O[P@](=O)(O)OC[C@H]3O[C@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@H](O)[C@@H]2O)ccc1C(=O)c1ccncc1 |
|
GD040526 | 1.91 | 687.87 | C35H61O12N | CO[C@@H]1C[C@@H](O[C@@H]2[C@H](C)C(=O)O[C@H](C)[C@H](C)[C@H](O)[C@H](C)C(=O)[C@@]3(CO3)C[C@H](C)[C@@H](O[C@H]3O[C@H](C)C[C@@H](N(C)C)[C@H]3O)[C@@H]2C)O[C@H](C)[C@@H]1O |
|
GD040527 | -0.18 | 335.36 | C15H21O4N5 | CC(C)=CCNc1ncnc2c1ncn2[C@H]1O[C@H](CO)[C@H](O)[C@@H]1O |