natural glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD118682 | 1.13 | 918.9 | C44H54O21 | COc1cc(C=CC(=O)OCC2(O)COC(OCC3OC(Oc4c(OC)cc(C5OCC6C(c7cc(OC)c(O)c(OC)c7)OCC56)cc4OC)C(O)C(O)C3O)C2O)cc(OC)c1O |
|
GD118683 | -1.4 | 848.76 | C39H44O21 | COc1cc2c(OC3OCC(O)(COC4OCC(O)C(OC5OC(CO)C(O)C(O)C5O)C4O)C3OC(C)=O)c3c(c(-c4ccc5c(c4)OCO5)c2cc1OC)C(=O)OC3 |
|
GD118684 | -0.95 | 539.58 | C26H37O11N | C=C1CC(OC2CCCNC2)C2C(C(=O)O)C(=O)OC2C2C(C)=C(OC3OC(CO)C(O)C(O)C3O)CC12 |
|
GD118685 | 3.49 | 921.79 | C31H54O17N7P3S | CCCCCCCCCC(=O)SCCN=C(O)CCN=C(O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O |
|
GD118686 | 6.42 | 1339.61 | C69H110O25 | CCCCCCCCCC(=O)OC1C(OC2C(C)OC3OC4C(OC(CCCCC)CCCCCCCCCC(=O)OC2C3O)OC(C)C(O)C4O)OC(C)C(OC2OC(C)C(OC(=O)C(C)C)C(O)C2OC(=O)C=Cc2ccccc2)C1OC1OC(C)C(O)C(O)C1O |
|
GD118687 | -6.82 | 504.44 | C18H32O16 | CC(O)C(OC1OC(CO)C(OC2OC(C(=O)O)C(O)C(O)C2O)C(O)C1O)C(O)C(O)CO |
|
GD118688 | 1.41 | 666.85 | C36H58O11 | CC1CCC2(C(=O)OC3OC(CO)C(O)C(O)C3O)C(O)CC3(C)C(=CCC4C5(C)CCC(O)C(C)(CO)C5CCC43C)C2C1(C)O |
|
GD118689 | 3.32 | 634.85 | C36H58O9 | CC1CCC2(C(=O)OC3OC(CO)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(CO)C5CCC43C)C2C1C |
|
GD118690 | 1.48 | 1546.84 | C73H131O31N3 | CCCCCCCCCCCCCC=CC(O)C(COC1OC(CO)C(OC2OC(CO)C(OC3OC(CO)C(O)C(OC4OC(CO)C(O)C(O)C4O)C3N=C(C)O)C(OCC(O)C(O)C3OC(O)(C(=O)O)CC(O)C3N=C(C)O)C2O)C(O)C1O)N=C(O)CCCCCCCCCCCCCCCCC |
|
GD118691 | 2.38 | 678.86 | C37H58O11 | CC(=O)OC1CC2C3=CCC4CC(OC5OC(CO)C(O)C(O)C5O)CCC4(C)C3=CCC2(C)C1C(C)C(O)C(O)C1(C(C)C)OC1C |