synthetic glycosides
Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
---|---|---|---|---|---|
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GD045736 | -0.84 | 298.32 | C11H14O4N4S | CSc1ncnc2c1ncn2[C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O |
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GD062806 | -1.14 | 370.31 | C15H18O9N2 | CC(=O)OC[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
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GD058926 | -0.26 | 332.31 | C14H20O9 | CC(=O)OC[C@H]1OC[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
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GD045331 | -0.63 | 270.33 | C13H22O4N2 | Cc1cc(N)c(NC[C@H](O)[C@@H](O)[C@H](O)CO)cc1C |
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GD041166 | -1.54 | 178.18 | C7H14O5 | CO[C@@H]1[C@H](O)[C@H](C)O[C@H](O)[C@@H]1O |
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GD041167 | -1.54 | 178.18 | C7H14O5 | CO[C@@H]1O[C@H](C)[C@@H](O)[C@H](O)[C@H]1O |
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GD042449 | -0.36 | 240.26 | C12H16O5 | OC[C@@H]1O[C@@H](OCc2ccccc2)[C@H](O)[C@@H]1O |
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GD092470 | 0.91 | 449.69 | C17H18O6N2ClBr | CC(=O)N[C@H]1[C@H](O)[C@H](O)[C@H](CO)O[C@@H]1Oc1c[nH]c2ccc(Br)c(Cl)c12 |
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GD085254 | 0.85 | 422.62 | C15H13O7NClBr | O=C(O)[C@@H]1O[C@@H](Oc2c[nH]c3ccc(Br)c(Cl)c23)[C@@H](O)[C@H](O)[C@H]1O |
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GD043922 | -1.91 | 277.66 | C10H12O5N3Cl | Nc1nc(=O)n([C@@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)cc1Cl |