natural glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD116083 | -1.32 | 790.78 | C38H42O13N6 | CNC(=N)NCc1c(C)cc2c(c1O)C(=O)c1c(OC3OC(CO)C(O)(CC(CN4C(=O)C=CC4=O)c4cc[nH]c(=N)c4)C(O)C3O)cc(OC)c(CO)c1C2=O |
|
GD116084 | 1.59 | 1171.38 | C59H94O23 | CCCCOC(C)(C)C=CCC1(C)OC(=O)C23CCC4C(=CCC5C(C)(C)C(OC6OCC(O)C(O)C6OC6OC(C)C(OC7OC(CO)C(O)C(OC8OCC(O)C(OC)C8O)C7O)C(O)C6O)CCC45C)C2(C)CC(OC(C)=O)C13 |
|
GD116085 | 9.83 | 921.24 | C47H84O15S | CCCCCCCCCCCCCCCC(=O)OCC(COC1OC(CS(=O)(=O)O)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O)OC(=O)CCCCCCCCCCCCCCC |
|
GD116086 | -1.26 | 484.37 | C20H20O14 | O=C(OC1OC(CO)C(O)C(OC(=O)c2cc(O)c(O)c(O)c2)C1O)c1cc(O)c(O)c(O)c1 |
|
GD116087 | -1.93 | 320.34 | C14H24O8 | O=C1CCC(O)(CCOC2OC(CO)C(O)C(O)C2O)CC1 |
|
GD116088 | 6.9 | 947.18 | C56H70O11N2 | CCc1c[nH]cc1CC1C=CC2CC3(C)C45CCC6(C(=O)O)C(COC)CC7(C)CC=CC68C4=CC4CCC69C=CC(=CC5C(O)=NC78)C43C16C2C(C)(C)C(OC1OC(C(=O)O)C(O)C(O)C1O)C9 |
|
GD116089 | -3.92 | 2153.37 | C102H161O47N | C=CC(C)(O)CCC=C(C)C(=O)OC1C(OC(C)(C=C)CCC=C(C)C(=O)OCC2OC(OC(=O)C34CCC(C)(C)CC3C3=CCC5C6(C)CCC(OC7OC(COC8OCC(O)C(O)C8OC8OCC(O)C(O)C8O)C(O)C(O)C7N=C(C)O)C(C)(C)C6CCC5(C)C3(C)CC4O)C(OC3OC(C)C(OC4OCC(O)C(OC5OCC(O)C(O)C5O)C4O)C(OC4OC(CO)C(O)C(O)C4O)C3O)C(O)C2O)OC(C)C(O)C1O |
|
GD116090 | 4.15 | 662.86 | C37H58O10 | C=C(CC)C1CCC2(C(=O)OC3(O)OC(CO)C(O)C(O)C3O)CCC3(C)C(CCC4C5(C)CCCC(C)(C(=O)O)C5CCC43C)C12 |
|
GD116091 | 10.79 | 786.23 | C46H91O8N | CCCCCCCCCCCCCCCCCCCCCC(O)=NC(COC1OC(CO)C(O)C(O)C1O)C(O)CCCCCCCCCCCCCCC |
|
GD116092 | 1.95 | 756.72 | C39H36O14N2 | Cc1cc(C)cc(C2=C3N=CC=C3CN2OC2C(Oc3ccc4c(=O)c(-c5ccc(O)cc5)coc4c3)OC(COC(=O)C(O)C(=O)O)C(O)C2(O)CO)c1 |