natural glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD120892 | -1.6 | 678.77 | C32H54O15 | CC1(C)C(OC2OC(CO)C(O)C(O)C2O)CCC2(C)C3CCC(C)(C(O)COC4OC(CO)C(O)C(O)C4O)C(OO)C3=CCC12 |
|
GD120893 | -1.98 | 162.14 | C6H10O5 | CC(=O)C1(O)OCC(O)C1O |
|
GD120894 | 8.34 | 1356.48 | C74H85O23N | COC(=O)C1(OC2C(O)C(OC3C(COCc4ccccc4)OC(OCc4ccccc4)C(OCc4ccccc4)C3OCc3ccccc3)OC(COCc3ccccc3)C2OCc2ccccc2)CC(OC(C)=O)C(N=C(C)O)C(C(OC(C)=O)C(COC(C)=O)OC(C)=O)O1 |
|
GD120895 | 1.14 | 492.52 | C25H32O10 | CC1(CO)OC(Oc2ccc(C(=O)CC(O)c3ccc(O)cc3)c(O)c2)C(C)(O)C(C)(O)C1(C)O |
|
GD120896 | 3.17 | 690.87 | C38H58O11 | CC(=O)OC1C(O)CC(C)OC1OC1CC2(C)C3CC=C4C(CC(O)C(O)C4(C)C)C3(C)C(=O)CC2(C)C1C(C)(O)C(=O)C=CC(C)(C)O |
|
GD120897 | -4.33 | 1525.6 | C70H108O36 | CC(=O)OCC1(O)COC(OC2C(O)C(OC3C(OC(=O)C45CCC(C)(C)CC4C4=CCC6C7(C)CC(O)C(OC8OC(CO)C(O)C(O)C8OC8OC(CO)C(O)C(O)C8O)C(C)(C(=O)O)C7CCC6(C)C4(CO)CC5)OC(C)C(OC(C)=O)C3OC(C)=O)OC(C)C2OC2OCC(O)C(O)C2O)C1O |
|
GD120898 | -0.37 | 1059.25 | C53H86O21 | CC(C)=CCCC(C)C1C(OC2OC(CO)C(O)C2O)CC2(C)C3CCC4C(C)(C(=O)OC5OC(C)C(O)C(O)C5O)C(OC5OC(C)C(O)C(O)C5OC5OC(CO)C(O)C(O)C5O)CCC45CC35CCC12C |
|
GD120899 | 4.23 | 1165.46 | C58H104O21N2 | CCCCCCCC=CCCCCCCCC(O)=NC(COC1OC(CO)C(OC2OC(CO)C(O)C(OC3(C(=O)O)CC(O)C(N=C(C)O)C(C(O)C(O)CO)O3)C2O)C(O)C1O)C(O)C=CCCCCCCCCCCCCC |
|
GD120900 | -10.07 | 853.77 | C32H55O25N | CC(O)=NC1C(OC2C(O)C(CO)OC(OC(C(O)CO)C(O)C(O)C=O)C2O)OC(CO)C(O)C1OC1OC(CO)C(O)C(O)C1OC1OC(C)C(O)C(O)C1O |
|
GD120901 | 3.98 | 907.1 | C48H74O16 | CCCCOC(=O)C1OC(OC2CCC3(C)C(CCC4(C)C3C(=O)C=C3C5CC(C)(C(=O)O)CCC5(C)CCC34C)C2(C)C)C(OC2OC(C(=O)OCC)C(O)C(O)C2O)C(O)C1O |