synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD109905 | 2.6 | 661.64 | C30H31O14NS | CCOC(=O)c1oc2cc(OC[C@@H]3O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]3OC(C)=O)ccc2c(=O)c1-c1cscn1 |
|
GD109906 | 2.6 | 661.64 | C30H31O14NS | CCOC(=O)c1oc2cc(OC[C@@H]3O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]3OC(C)=O)ccc2c(=O)c1-c1cscn1 |
|
GD099522 | 0.64 | 469.42 | C21H24O10NF | CC(=O)OC[C@@H]1O[C@H](OC(C)=O)[C@H](NC(=O)c2ccc(F)cc2)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD099520 | 0.64 | 469.42 | C21H24O10NF | CC(=O)OC[C@@H]1O[C@H](OC(C)=O)[C@H](NC(=O)c2ccc(F)cc2)[C@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD099521 | 0.64 | 469.42 | C21H24O10NF | CC(=O)OC[C@@H]1O[C@H](OC(C)=O)[C@H](NC(=O)c2ccc(F)cc2)[C@@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD067687 | -0.37 | 367.31 | C11H12O4N5F3S | Nc1nc(SC(F)(F)F)nc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1O |
|
GD067668 | -0.37 | 367.31 | C11H12O4N5F3S | Nc1nc(SC(F)(F)F)nc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@@H]1O |
|
GD067667 | -0.37 | 367.31 | C11H12O4N5F3S | Nc1nc(SC(F)(F)F)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |
|
GD105789 | -4.77 | 520.58 | C22H40O10N4 | CC(=O)O[C@H](C(=O)NCC[NH+](C)C)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)C(=O)NCC[NH+](C)C |
|
GD109908 | 2.71 | 578.57 | C30H30O10N2 | CC(=O)OC[C@@H]1O[C@H](OC(C)=O)[C@H](NC(=O)c2cc(-c3ccccc3)nc3ccccc23)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |