natural glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD119852 | 7.85 | 680.92 | C41H60O8 | CC(C)=CCCC(C)=CCCC(C)=CC=CC=C(C)C=CC=C(C)C=CC=C(C)C(=O)OC1OC(COC(=O)CC(C)C)C(O)C(O)C1O |
|
GD119853 | 0.3 | 917.14 | C47H80O17 | CC(C)(OC1OC(CO)C(OC2OC(CO)C(O)C(O)C2O)C(O)C1O)C1CCC2(C)C1C(O)CC1(C)C2CCC2C3(C)CCC(OC4OCC(O)C(O)C4O)C(C)(C)C3CCC21C |
|
GD119854 | 1.93 | 484.46 | C25H24O10 | O=C(OCC1OC(Oc2ccc(Oc3ccc(O)cc3)cc2)C(O)C(O)C1O)c1ccc(O)cc1 |
|
GD119855 | -6.21 | 431.39 | C15H29O13N | CC(C[NH+]([O-])O)OC1OC(CO)C(O)C(OC2OC(CO)C(O)C(O)C2O)C1O |
|
GD119856 | 1.12 | 825.0 | C43H68O15 | COC(=O)C1OC(OC2CCC3(C)C(CCC4(C)C3CC=C3C5CC(C)(C)CCC5(C)C(=O)C(O)C34C)C2(C)CO)C(O)C(OC2OC(CO)C(O)C(O)C2O)C1O |
|
GD119857 | -1.45 | 451.54 | C13H25O10NS3 | CSCCC(O)CCC(=NOS(=O)(=O)O)SC1OC(CO)C(O)C(O)C1O |
|
GD119858 | 0.49 | 540.48 | C27H24O12 | Cc1cc(O)c2c(c1)C(O)(OC1OC(OC(=O)c3ccccc3)C(O)C(O)C1O)c1cc(O)cc(O)c1C2=O |
|
GD119859 | 5.02 | 1071.65 | C57H75O18Cl | CC(=O)C(C)(O)C(O)CC1CC23OC(=O)C(=C2O)C(=O)C2(C)C(C=CC4C(OC5OC(C)C(O)C(OC6OC(C)C(OC(=O)c7c(O)ccc(Cl)c7C)C(O)C6O)C5O)C(C)CC(C)C42)C(C)C=CCC3(C)C=C1C |
|
GD119860 | -5.7 | 720.67 | C31H44O19 | O=C(OC1C2C=COC(OC3OC(CO)C(O)C(O)C3O)C2C2(CO)OC12)C1COC(OC2OC(CO)C(O)C(O)C2O)C2C(CO)=CCC12 |
|
GD119861 | 3.01 | 462.45 | C26H22O8 | O=C(OC1OCC(O)C(OC(=O)c2ccccc2)C1OC(=O)c1ccccc1)c1ccccc1 |