natural glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD121612 | -1.38 | 624.55 | C28H32O16 | COc1cc(O)c2c(=O)c(OC3OC(CO)C(O)C(O)C3OC3OC(C)C(O)C(O)C3O)c(-c3ccc(O)c(O)c3)oc2c1 |
|
GD121613 | 1.25 | 724.67 | C36H36O16 | CC1OC(Oc2cc(O)c3c(=O)c(OC4OC(C)C(O)C(O)C4OC(=O)C=Cc4ccc(O)cc4)c(-c4ccc(O)cc4)oc3c2)C(O)C(O)C1O |
|
GD121614 | -18.66 | 1559.39 | C58H98O46N2 | CC(O)=NC1C(O)OC(CO)C(OC2OC(CO)C(OC3OC(COC4OC(COC5OC(CO)C(O)C(O)C5O)C(O)C(OC5OC(CO)C(O)C(O)C5OC5OC(C(O)CO)C(O)C5O)C4O)C(O)C(OC4OC(CO)C(O)C(O)C4OC4OC(CO)C(O)C(O)C4O)C3O)C(O)C2N=C(C)O)C1O |
|
GD121615 | 3.2 | 1185.41 | C60H96O23 | CC=C(C)C(=O)OC1CC2C3(C)CCC(OC4CC(OC)C(OC5CC(OC)C(OC6CC(OC)C(OC7CC(OC)C(OC8OC(CO)C(O)C(O)C8O)C(C)O7)C(C)O6)C(C)O5)C(C)O4)CC3=CCC2(O)C2(O)CCC(C(C)=O)C12C |
|
GD121616 | 3.5 | 636.87 | C36H60O9 | CC(CCC(OC1OC(CO)C(O)C(O)C1O)C(C)(C)O)C1CCC2(C)C3CC=C4C(CCC(O)C4(C)C)C3(C)C(=O)CC12C |
|
GD121617 | 8.47 | 1224.53 | C67H101O19N | CCC1C=CC2C=C(C)C(OC3CC(C)(O)C(N=C(C)O)C(C)O3)C(C)C=C(C)C3C=CC4C(OC5CCC(OC6CC(OC7CCC(O)C(C)O7)C(OC7CC(O)C(O)C(C)O7)C(C)O6)C(C)O5)C(C)CC(C)C4C3(C)C(O)=C3C(=O)OC2(C1)C3=O |
|
GD121618 | -1.35 | 1235.42 | C60H98O26 | CC1OC(OC2C(C)OC(OC3C(C)OC(OC4C(OC5C(C(=O)O)OC(OC6CCC7(C)C(CCC8(C)C7CCC79OCC%10(CCC(C)(C)CC%107)C(O)CC89C)C6(C)C)C(O)C5O)OC(CO)C(O)C4O)C(O)C3O)C(O)C2O)C(O)C(O)C1O |
|
GD121619 | -1.57 | 177.2 | C7H15O4N | COC1C(O)OC(C)C(O)C1N |
|
GD121620 | -3.01 | 424.44 | C18H32O11 | CC(=CCOC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1O)C(C)(C)O |
|
GD121621 | -2.86 | 710.64 | C32H38O18 | CC1OC(Oc2cc(O)c3c(=O)c(OC4(C5OC(C)C(O)C(O)C5O)OCC(O)C(O)C4O)c(-c4ccc(O)cc4)oc3c2)C(O)C(O)C1O |