natural glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD118262 | 9.1 | 2446.99 | C122H212O48 | CCCCCCCCCC(=O)OC1C(OC2C(C)OC(OC3C(OC(CCCCC)CCCCCCCCCC(=O)OC4C(C)OC(OC5C(OC6OC(C)C(OC(=O)C(C)CC)C(O)C6O)C(C)OC(OC6C(C)OC7OC8C(OC(CCCCC)CCCCCCCCCC(=O)OC6C7O)OC(C)C(O)C8O)C5OC(=O)CCCCCCCCC)C(O)C4O)OC(C)C(O)C3O)C(O)C2O)OC(C)C(OC2OC(C)C(OC(=O)C(C)CC)C(O)C2O)C1OC1OC(C)C(O)C(O)C1O |
|
GD118263 | -0.21 | 902.85 | C43H50O21 | COc1cc(C=CC(=O)OC2C(OC3C4C=COC(OC5OC(CO)C(O)C(O)C5O)C4C4(CO)OC34)OC(C)C(OC(C)=O)C2OC(=O)C=Cc2ccc(O)c(OC)c2)ccc1O |
|
GD118264 | 0.38 | 442.51 | C22H34O9 | CC=C(C)C1CC=C(C)C(OC2OC(CO)C(O)C2O)C(O)C(=O)CCC(C)C(=O)O1 |
|
GD118265 | 3.98 | 1201.45 | C61H100O23 | COC1CC2(COC3CC(OCC4(O)CCC5C6(C)CC=C7CC(O)CCC7(C)C6CCC54C)OC(C)C3OO2)OC(C)C1OC1CC(O)C(OC2CC(O)C(OC3CC(OC)C(OC4OC(C)C(O)C(OC)C4O)C(C)O3)C(C)O2)C(C)O1 |
|
GD118266 | -1.66 | 308.33 | C13H24O8 | COC1C(O)C(C)OC(OC2C(O)CC(O)OC2C)C1O |
|
GD118267 | -0.09 | 289.33 | C13H23O6N | COC1OC(C)C(N(C)C(C)=O)C(C)(O)C1OC(C)=O |
|
GD118268 | 5.27 | 1215.46 | C59H107O23P | CCCCCCCCCCCCCC=CC=CC(=O)OC(COC(=O)CCCCCCCCCCCCCCCCCCC)COP(=O)(O)OC1C(OC2OC(CO)C(O)C(O)C2O)C(O)C(O)C(O)C1OC1OC(CO)C(O)C(O)C1O |
|
GD118269 | 0.36 | 356.42 | C18H28O7 | CC(=O)OCC1OC(OC2C3CC=C(C)C2C3(C)C)C(O)C(O)C1O |
|
GD118270 | 0.22 | 590.62 | C30H38O12 | C=C1C(=O)OC2C1CCC1(C)C(OC(=O)C(O)Cc3ccc(O)cc3)CCC(=COC3OC(CO)C(O)C(O)C3O)C21 |
|
GD118271 | -1.19 | 1275.44 | C62H98O27 | CC=C(C)C(=O)OC1C(OC(=O)C(C)CC)C2(CO)C(O)CC3(C)C(=CCC4C5(C)CCC(OC6OC(C(=O)O)C(O)C(OC7OCC(O)C(O)C7OC7OCC(O)C(O)C7O)C6OC6OC(CO)C(O)C(O)C6O)C(C)(CO)C5CCC43C)C2CC1(C)C |