synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD110682 | 3.13 | 631.68 | C34H37O9N3 | COc1ccc(C(OC[C@H]2O[C@@H](n3ncc(=O)[nH]c3=O)[C@H](O[C@@H]3CCCCO3)[C@@H]2O)(c2ccccc2)c2ccc(OC)cc2)cc1 |
|
GD110681 | 3.13 | 631.68 | C34H37O9N3 | COc1ccc(C(OC[C@H]2O[C@@H](n3ncc(=O)[nH]c3=O)[C@H](O[C@H]3CCCCO3)[C@@H]2O)(c2ccccc2)c2ccc(OC)cc2)cc1 |
|
GD108028 | 1.91 | 530.53 | C26H30O10N2 | COc1ccc2c(c1)CCc1cnn([C@H]3O[C@@H](COC(C)=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]3OC(C)=O)c1-2 |
|
GD109156 | 2.47 | 545.59 | C30H31O7N3 | COc1ccc(C(O[C@@H]2[C@@H](CO)O[C@@H](n3ccc(N)nc3=O)[C@@H]2O)(c2ccccc2)c2ccc(OC)cc2)cc1 |
|
GD112356 | 4.28 | 611.64 | C31H25O7N5S | Nc1nc2c(ncn2[C@@H]2O[C@H](COC(=O)c3ccccc3)[C@@H](OC(=O)c3ccccc3)[C@H]2OC(=O)c2ccccc2)c(=S)[nH]1 |
|
GD111693 | 3.93 | 643.74 | C31H45O8N7 | O=C(NC1CCCCC1)OC[C@H]1O[C@@H](n2cnc3c(=O)[nH]cnc32)[C@H](OC(=O)NC2CCCCC2)[C@@H]1OC(=O)NC1CCCCC1 |
|
GD110839 | 3.07 | 580.59 | C30H32O10N2 | COc1ccc2c3c(ccc2c1)-c1c(cnn1[C@@H]1O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O)CC3 |
|
GD108029 | 1.92 | 560.56 | C27H32O11N2 | COc1cc2c(cc1OC)-c1c(cnn1[C@@H]1O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O)CC2 |
|
GD111694 | 3.86 | 600.67 | C31H40O10N2 | CCCCCCOc1ccc2c(c1)CCc1cnn([C@H]3O[C@@H](COC(C)=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]3OC(C)=O)c1-2 |
|
GD112159 | 3.91 | 540.59 | C28H28O9S | CO[C@@H]1O[C@H](C)[C@@H](OS(=O)(=O)c2ccc(C)cc2)[C@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1 |