natural glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD118432 | 2.72 | 939.1 | C48H74O18 | COC1CC(OC2CC3=CCC4C(=O)C(C)(c5ccoc5C)CCC4C3(C)CC2O)OC(C)C1OC1CC(OC)C(OC2CC(OC)C(OC3OC(CO)C(O)C(O)C3O)C(C)O2)C(C)O1 |
|
GD118433 | -0.02 | 422.39 | C20H22O10 | O=C(OCC1OC(OCc2ccccc2)C(O)C(O)C1O)c1cc(O)c(O)c(O)c1 |
|
GD118434 | -1.85 | 1045.18 | C51H80O22 | CC1=C(C(=O)CC(C)COC2OC(CO)C(O)C(O)C2O)OC2CC3C4CC=C5CC(OC6OC(CO)C(OC7OC(C)C(O)C(O)C7O)C(O)C6OC6OC(C)C(O)C(O)C6O)CCC5(C)C4CCC3(C)C12 |
|
GD118435 | -1.43 | 959.13 | C48H78O19 | CC1OC(OC2CCC3(C)C(CCC4(C)C3C=CC35OCC6(CCC(C)(CO)CC63)C(O)CC45C)C2(C)CO)C(OC2OC(CO)C(O)C(O)C2O)C(OC2OC(CO)C(O)C(O)C2O)C1O |
|
GD118436 | -1.1 | 402.41 | C18H22O5N6 | Cc1ccc(CN=c2[nH]c3c(O)nc(=N)[nH]c3n2C2OC(CO)C(O)C2O)cc1 |
|
GD118437 | 2.66 | 674.83 | C37H54O11 | COC(C)(C)C1CC(=O)C(C)C2C(CC3(C)C4CC=C5C(C=C(OC6OC(CO)C(O)C(O)C6O)C(=O)C5(C)C)C4(C)C(=O)CC23C)O1 |
|
GD118438 | -1.73 | 622.53 | C28H30O16 | COc1cc2oc(-c3ccccc3)cc(=O)c2c(OC2OC(C(=O)O)C(OC3OC(CO)C(O)C(O)C3O)C(O)C2O)c1O |
|
GD118439 | 0.38 | 399.48 | C20H33O7N | CCC(C)C(=O)OC1CCN2CC=C(COC(=O)C(O)(C(C)O)C(C)(C)O)C12 |
|
GD118440 | 1.2 | 660.63 | C32H36O15 | O=C(CCc1ccc(O)c(O)c1)CC(CCc1ccc(O)c(O)c1)OC1OC(COC(=O)c2cc(O)c(O)c(O)c2)C(O)C(O)C1O |
|
GD118441 | -0.47 | 388.41 | C18H28O9 | COCC1OC(OC2OC=C(C(=O)OC)C3CCC(C)C23)C(O)C(O)C1O |