natural glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD117192 | 2.22 | 326.43 | C18H30O5 | C=CC(C)(C)C1(C)OC=CC1(C)CC(=O)C(O)C(OC)C(C)O |
|
GD117193 | 0.45 | 534.56 | C27H34O11 | COc1c2cc(c(OC3OC(CO)C(O)C(O)C3O)c1OC)CCCCC(=O)C(O)Cc1ccc(O)c-2c1 |
|
GD117194 | 3.9 | 1077.27 | C56H84O20 | COC1CC(OC2CCC3(C)C4CC(OC(=O)c5ccccc5)C5(C)C(C(C)=O)CCC5(O)C4(O)CC4OC43C2)OC(C)C1OC1CC(OC)C(OC2CC(OC)C(OC3OC(C)C(O)C(OC)C3O)C(C)O2)C(C)O1 |
|
GD117195 | 4.52 | 938.04 | C51H59O14N3 | O=C(C=Cc1ccc(O)c(Cc2cnc[nH]2)c1)N1c2cc(OC3(O)OC(CO)C(O)C(O)C3O)c(O)cc2C2C(C3(c4ccccc4O)CCCCC3)C(CCC3(O)CCCCC3)=CC21C(=O)O |
|
GD117196 | 5.85 | 979.14 | C54H66O13N4 | CCc1c2cc[nH]c2cn1-c1c2c(cc3c(=O)cc(C)oc13)CC(OOCC(O)(Cc1ccc(O)c3ccc(O)cc13)C(O)C(O)C(O)CO)C1(CC(C3CN=C(O)C3)CCC1CNC1CCCCC1)O2 |
|
GD117197 | 7.18 | 1199.48 | C65H98O20 | COC1CC(OC2C(C)OC(OC3C(C)OC(OC4C(C)OC(OC5CCC6(C)C(=CCC7(O)C6CC(OC(=O)C=Cc6ccccc6)C6(C)C(O)(C(C)OC(=O)C=C(C)C(C)C)CCC76O)C5)CC4OC)CC3OC)CC2OC)OC(C)C1O |
|
GD117198 | -2.89 | 935.07 | C45H74O20 | C=C(CCC1(O)OC2CC3C4CCC5CC(OC6OC(CO)C(OC7OC(CO)C(O)C(O)C7O)C(O)C6O)CC(O)C5(C)C4CCC3(C)C2C1C)COC1OC(CO)C(O)C(O)C1O |
|
GD117199 | 0.24 | 391.47 | C19H29O4N5 | CN(CCc1ncnc2c1ncn2C1OC(CO)C(O)C1O)C1CCCCC1 |
|
GD117200 | -4.03 | 450.39 | C18H26O13 | COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(C(=O)OC)C(O)C(O)C12 |
|
GD117201 | 1.41 | 799.91 | C39H61O16N | COC1C(OC(C)=O)CC(=O)OC(C)CC2OC2C=CC(=O)C(C)CC(CC=O)C1OC1OC(C)C(OC2CC(C)(O)C(OC(C)=O)C(C)O2)C(N(C)C)C1O |