natural glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD117842 | 2.32 | 853.06 | C45H72O15 | C=C(CC1OC23OCC4(C(CCC5C6(C)CCC(OC7OC(CO)C(O)C(O)C7OC7OC(C)C(O)C(O)C7O)C(C)(C)C6CCC54C)C2C1(C)O)C3OC(C)=O)C(C)C |
|
GD117843 | 2.62 | 344.45 | C18H32O6 | CC1OC(OCCCCCCCCCC=CC(=O)O)C(O)CC1O |
|
GD117844 | 4.62 | 1113.39 | C58H96O20 | COCC(CC1OC(O)(C(O)C2CC(OC)CCCC=C(C)C=CC(OC3OC(C)C(OC)C(O)C3O)C(C)C=C(C)C=C(C)C=C(C)C(=O)O2)C(C)C(O)C1C)OC1CC(C)(O)C(OC2CC(OC)C(O)C(C)O2)C(C)O1 |
|
GD117845 | 1.51 | 524.56 | C26H36O11 | CC1=CC(=O)CC(C)(C)C1CCC(C)OC1OC(COC(=O)c2cc(O)c(O)c(O)c2)C(O)C(O)C1O |
|
GD117846 | -2.3 | 599.52 | C26H31O16 | Oc1cc(O)c2c(c1)OC(c1cc(O)c(O)c(O)c1)C(OC1OC(C[OH2+])C(O)C(O)C1OC1OCC(O)C(O)C1O)=C2 |
|
GD117847 | 2.95 | 622.84 | C35H58O9 | COC1C(O)C(CO)OC(OCC(C)C(C)C=CC(C)C2CC=C3C2(C)CCC2C3(O)CC(O)C3CC(O)CCC32C)C1O |
|
GD117848 | -1.39 | 538.55 | C26H34O12 | COc1cc2c(cc1O)C(c1ccc(OC3OC(CO)C(O)C(O)C3O)c(OC)c1)C(CO)C(O)(CO)C2 |
|
GD117849 | -0.64 | 1145.25 | C55H84O25 | CC(=O)OC1C(C)OC(OC(=O)C23CCC(C)(C)CC2C2=CCC4C5(C)CC(O)C(OC6OC(C(=O)O)C(O)C(O)C6O)C(C)(C(=O)O)C5CCC4(C)C2(C)CC3)C(OC2OC(C)C(O)C(O)C2O)C1OC1OCC(O)(CO)C1O |
|
GD117850 | 0.32 | 558.58 | C26H38O13 | C=CC1C(OC2OC(COC(=O)C(C)=CCCC(C)CCO)C(O)C(O)C2O)OC=C(C(=O)O)C1CC(=O)O |
|
GD117851 | -3.41 | 420.37 | C17H24O12 | Cc1c(OC2OC(CO)C(O)C(O)C2OC2OCC(O)(CO)C2O)occc1=O |