synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD113887 | 5.86 | 569.61 | C33H31O8N | O=C(O[C@@H]1O[C@H](COCc2ccccc2)[C@@H](OCc2ccccc2)[C@H]1OCc1ccccc1)c1ccc([N+](=O)[O-])cc1 |
|
GD108075 | 1.33 | 549.31 | C20H24O9NI | CC(=O)N[C@H]1[C@H](Oc2ccc(I)cc2)O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD111094 | 3.16 | 618.68 | C34H38O9N2 | COCCO[C@@H]1[C@H](O)[C@@H](COC(c2ccccc2)(c2ccc(OC)cc2)c2ccc(OC)cc2)O[C@H]1n1cc(C)c(=O)[nH]c1=O |
|
GD111989 | 3.53 | 639.68 | C31H33O10N3S | COc1ccccc1Cc1nc(-c2ccccc2)nn([C@@H]2O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]2OC(C)=O)c1=S |
|
GD112087 | 3.53 | 639.68 | C31H33O10N3S | COc1ccccc1Cc1nc(-c2ccccc2)nn([C@@H]2O[C@@H](COC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]2OC(C)=O)c1=S |
|
GD111988 | 3.53 | 639.68 | C31H33O10N3S | COc1ccccc1Cc1nc(-c2ccccc2)nn([C@@H]2O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]2OC(C)=O)c1=S |
|
GD112088 | 3.53 | 639.68 | C31H33O10N3S | COc1ccccc1Cc1nc(-c2ccccc2)nn([C@@H]2O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]2OC(C)=O)c1=S |
|
GD112557 | 2.88 | 670.57 | C35H35O7N4Cl2 | CC[NH+](CC)CCN1C(=O)c2c(c3c4cccc(Cl)c4n([C@H]4O[C@@H](CO)[C@@H](OC)[C@@H](O)[C@H]4O)c3c3[nH]c4c(Cl)cccc4c23)C1=O |
|
GD112555 | 2.88 | 670.57 | C35H35O7N4Cl2 | CC[NH+](CC)CCN1C(=O)c2c(c3c4cccc(Cl)c4n([C@@H]4O[C@@H](CO)[C@@H](OC)[C@@H](O)[C@H]4O)c3c3[nH]c4c(Cl)cccc4c23)C1=O |
|
GD105579 | 4.53 | 495.71 | C27H49O5N3 | CCCCCCCCCCCCCCCCCCNc1ccn([C@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)c(=O)n1 |