synthetic glycosides
Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
---|---|---|---|---|---|
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GD083070 | -0.26 | 421.44 | C17H19O6N5S | Cc1ccc(S(=O)(=O)OC[C@@H]2O[C@H](n3cnc4c(N)ncnc43)[C@@H](O)[C@H]2O)cc1 |
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GD061682 | 0.03 | 347.32 | C17H17O7N | O=C(OC[C@@H]1O[C@@H](n2ccc(O)cc2=O)[C@@H](O)[C@H]1O)c1ccccc1 |
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GD075869 | -2.33 | 378.34 | C16H18O7N4 | COc1ccc2nc3c(=O)[nH]c(=O)nc-3n(C[C@@H](O)[C@H](O)[C@H](O)CO)c2c1 |
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GD042247 | -1.34 | 237.22 | C9H11O3N5 | Nc1ncnc2c1ncn2[C@H]1OC[C@@H](O)[C@H]1O |
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GD042496 | -0.59 | 239.27 | C12H17O4N | C[C@H](O)[C@@H](O)[C@H](O)C(=O)NCc1ccccc1 |
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GD085927 | 1.62 | 410.56 | C20H26O5S2 | OC[C@H](O)[C@H](O)[C@@H](O)[C@H](O)C(SCc1ccccc1)SCc1ccccc1 |
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GD046455 | 0.39 | 262.3 | C12H22O6 | CCCCOC(=O)[C@@H](O)[C@H](O)C(=O)OCCCC |
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GD046454 | 0.39 | 262.3 | C12H22O6 | CCCCOC(=O)[C@H](O)[C@@H](O)C(=O)OCCCC |
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GD058263 | -3.08 | 344.23 | C12H12O10N2 | O=C(ON1C(=O)CCC1=O)[C@@H](O)[C@H](O)C(=O)ON1C(=O)CCC1=O |
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GD058262 | -3.08 | 344.23 | C12H12O10N2 | O=C(ON1C(=O)CCC1=O)[C@H](O)[C@@H](O)C(=O)ON1C(=O)CCC1=O |