synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD106389 | 1.25 | 512.45 | C21H20O13S | O=C(O)[C@H]1O[C@@H](Oc2ccc3c(=O)c(-c4ccc(OS(O)(O)O)cc4)coc3c2)[C@H](O)[C@@H](O)[C@@H]1O |
|
GD108183 | 3.05 | 652.58 | C28H28O16S | COC(=O)[C@H]1O[C@@H](Oc2ccc3c(=O)c(-c4ccc(OS(O)(O)O)cc4)coc3c2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD107061 | 0.1 | 723.8 | C33H45O13N3S | CC(C)CN(C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)O[C@H]1CO[C@H]2OCC[C@@H]12)S(=O)(=O)c1ccc(N[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O)cc1 |
|
GD107060 | 0.29 | 723.8 | C33H45O13N3S | CC(C)CN(C[C@@H](O[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]1O)[C@H](Cc1ccccc1)NC(=O)O[C@H]1CO[C@H]2OCC[C@@H]12)S(=O)(=O)c1ccc(N)cc1 |
|
GD002797 | -1.83 | 243.22 | C10H13O6N | O=c1cc(O)ccn1[C@@H]1O[C@H](CO)[C@H](O)[C@H]1O |
|
GD042026 | -1.83 | 243.22 | C10H13O6N | O=c1cc(O)ccn1[C@@H]1O[C@H](CO)[C@H](O)[C@@H]1O |
|
GD076685 | -0.17 | 392.36 | C19H20O9 | COc1ccc2cc(CC(=O)O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O)ccc2c1 |
|
GD110351 | 2.65 | 717.75 | C34H39O14NS | COC(=O)[C@@H]1O[C@H](Oc2cc3c(c(OC)c2OC)-c2ccc(SC)c(=O)cc2[C@@H](NC(C)=O)CC3)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD107084 | 0.85 | 577.61 | C27H31O11NS | COc1c(O[C@H]2O[C@@H](C(=O)O)[C@H](O)[C@@H](O)[C@@H]2O)cc2c(c1OC)-c1ccc(SC)c(=O)cc1[C@@H](NC(C)=O)CC2 |
|
GD106055 | -1.23 | 618.59 | C26H38O15N2 | CC(=O)N[C@@H]1[C@@H](OC(C)=O)C[C@@H](COC(C)=O)O[C@H]1O[C@@H]1[C@@H](COC(C)=O)O[C@@H](OC(C)=O)[C@H](NC(C)=O)[C@H]1OC(C)=O |