natural glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD117622 | 7.17 | 881.2 | C52H80O11 | CCCCCC1CC2(C(=O)O)C(O)CC(C)(CO)CC2C2=CCC3C4(C5CCCCC5)CC(OCc5ccccc5)C(OC5OCC(O)C(O)C5O)C(C)(CO)C4CCC3(C)C21C |
|
GD117623 | -2.43 | 1077.22 | C52H84O23 | C=C(CCC1(OC)OC2CC3C4CC=C5CC(OC6OC(COC7OC(CO)C(O)C(O)C7O)C(O)C(O)C6OC6OC(C)C(O)C(O)C6O)CCC5(C)C4CCC3(C)C2C1C)COC1OC(CO)C(O)C(O)C1O |
|
GD117624 | 4.09 | 793.0 | C43H68O13 | CCOC(=O)C1OC(OC2CCC3(C)C(CCC4(C)C3CC=C3C5CC(C)(C)CCC5(C(=O)O)CCC34C)C2(C)C)C(O)C(OC2OCC(O)C(O)C2O)C1O |
|
GD117625 | -0.74 | 802.69 | C37H38O20 | COc1cc(C=CC(=O)OC2C(OC3C(Oc4c(-c5ccc(O)c(O)c5)oc5cc(O)cc(O)c5c4=O)OC(CO)C(O)C3O)OC(CO)C(O)C2O)ccc1O |
|
GD117626 | -0.6 | 522.42 | C23H22O14 | COc1c(OC)c2oc(=O)c3cc(OC4OC(CO)C(O)C(O)C4O)c(OC)c4oc(=O)c(c1O)c2c43 |
|
GD117627 | -0.39 | 412.39 | C19H24O10 | COc1cc(C)c2c(OC)c(C)c(=O)oc2c1OC1OC(CO)C(O)C(O)C1O |
|
GD117628 | 3.04 | 618.81 | C35H54O9 | CC1CC2OC3(CC4(C)C5=CCC6C(C)(C)C(OC7OCC(O)C(O)C7O)CCC67CC57C(O)CC4(C)C13)OC2C(C)(C)O |
|
GD117629 | 11.99 | 837.28 | C53H88O7 | CCC=CCC=CCC=CCCCCCCCC(=O)OCC1OC(OC2CCC3(C)C(=CCC4C3CCC3(C)C(C(C)CCC(CC)C(C)C)CCC43)C2)C(O)C(O)C1O |
|
GD117630 | 2.67 | 482.49 | C26H26O9 | COc1cc2c(oc(=O)c3cc(C)cc(OC)c32)c2c(C3OC(C(C)O)C(O)C3O)ccc(O)c12 |
|
GD117631 | -7.17 | 564.48 | C18H37O14N4P | NCC1OC(OC2C(N)CC(N)C(OC3OC(CO)C(O)C(N)C3O)C2O)C(O)C(OP(=O)(O)O)C1O |