synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD114135 | 5.04 | 646.72 | C34H34O9N2S | CC(=O)OC[C@H]1O[C@@H](n2c3c(c(-c4cccc5ccccc45)c(C#N)c2=S)CCCC3)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD114136 | 5.04 | 646.72 | C34H34O9N2S | CC(=O)OC[C@@H]1O[C@@H](n2c3c(c(-c4cccc5ccccc45)c(C#N)c2=S)CCCC3)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD042746 | -2.86 | 258.23 | C9H14O5N4 | NNc1ccn([C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)c(=O)n1 |
|
GD042743 | -2.86 | 258.23 | C9H14O5N4 | NNc1ccn([C@@H]2O[C@H](CO)[C@H](O)[C@@H]2O)c(=O)n1 |
|
GD046952 | -2.53 | 311.25 | C11H13O6N5 | Nc1ncnc2c1ncn2[C@@H]1O[C@H]([C@H](O)C(=O)O)[C@@H](O)[C@H]1O |
|
GD092983 | 1.03 | 437.45 | C21H27O9N | CC(=O)N[C@@H]1[C@H](Oc2ccccc2C)O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD103508 | 0.63 | 468.42 | C20H24O11N2 | CC(=O)N[C@@H]1[C@H](Oc2ccccc2[N+](=O)[O-])O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD099632 | 0.53 | 451.43 | C21H25O10N | CC(=O)N[C@@H]1[C@H](Oc2ccccc2C=O)O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD092984 | 1.03 | 437.45 | C21H27O9N | CC(=O)N[C@@H]1[C@H](Oc2cccc(C)c2)O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD108050 | 1.48 | 502.31 | C20H24O9NBr | CC(=O)N[C@@H]1[C@H](Oc2ccc(Br)cc2)O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |