natural glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD120822 | -2.17 | 1114.97 | C51H54O28 | O=C(C=Cc1ccc(O)c(O)c1)OCC1OC(OC2=CC(O)=C[C]3[OH+]C(c4cc(O)c(O)c(OC5OC(COC(=O)C=Cc6ccc(O)c(O)c6)C(O)C(O)C5O)c4)=C(OC4OC(CO)C(O)C(O)C4O)C=C32)C(O)C(O)C1O |
|
GD120823 | 1.32 | 770.79 | C41H42O13N2 | CC(=O)Oc1cc(CO)c2c(c1C=Cc1cccc(CCO)c1)C(=O)c1cc(OC3OC(C)C(O)C(O)(O)C3O)c(Cc3cccc(C(N)N)c3)c(O)c1C2=O |
|
GD120824 | 3.0 | 692.89 | C38H60O11 | CC(=O)OCC1OC(OC(=O)C23CCC(C)C(C)(O)C2C2=CCC4C5(C)CC(O)C(O)C(C)(C)C5CCC4(C)C2(C)CC3)C(O)C(O)C1O |
|
GD120825 | -1.07 | 540.52 | C25H32O13 | C=CC1C(OC2OC(CO)C(O)C(OC3OC(C)CC4=C3C(=O)OCC4)C2O)OC=C2C(=O)OCCC21O |
|
GD120826 | 1.85 | 796.99 | C42H68O14 | CC1(C)CCC2(C(=O)O)CCC3(CO)C(=CCC4C5(C)CCC(OC6OC(COC7OC(CO)C(O)C(O)C7O)C(O)C(O)C6O)C(C)(C)C5CCC43C)C2C1 |
|
GD120827 | -1.69 | 371.3 | C15H17O10N | N#CCOC1OC(COC(=O)c2cc(O)c(O)c(O)c2)C(O)C(O)C1O |
|
GD120828 | -2.09 | 324.33 | C16H20O7 | OCC=CC#CC#CC=CCOC1OC(CO)C(O)C(O)C1O |
|
GD120829 | -4.54 | 747.74 | C33H49O18N | COC1C(CO)OC(OC2C(CO)OC(OC3C(CO)OC(Oc4ccc(CC5NC(=O)C(=O)C5(C)C)cc4)C(O)C3O)C(OC)C2O)C(O)C1O |
|
GD120830 | 10.54 | 2473.07 | C125H218O47 | CCCCCCCCCCCC(=O)OC1C(OC2C(C)OC(OC3C(OC(CCCCC)CCCCCCCCCC(=O)OC4C(OC5C(OC6OC(C)C(OC(=O)C(C)C)C(O)C6O)C(C)OC(OC6C(C)OC7OC8C(OC(CCCCC)CCCCCCCCCC(=O)OC7C6O)OC(C)C(O)C8O)C5OC(=O)CCCCCCCCCCC)OC(C)C(O)C4O)OC(C)C(O)C3O)C(O)C2O)OC(C)C(OC2OC(C)C(OC(=O)C(C)C)C(O)C2O)C1OC1CC(C)C(O)C(O)C1O |
|
GD120831 | -0.08 | 817.02 | C42H72O15 | CC(CCC(O)C(C)(C)OC1OC(CO)C(O)C(O)C1O)C1C(O)CC2(C)C3C(O)CC4C(C)(C)C(OC5OC(CO)C(O)C(O)C5O)CCC45CC35CCC12C |