natural glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD121582 | 1.98 | 897.07 | C46H72O17 | CC=C(C)C(=O)OC1C(C)OC(OC2C(C)OC(OC3CCC4(C)C(=C(C=O)C5C4CCC4(C)C(C(C)OC6OC(CO)C(O)C(O)C6O)CCC54O)C3)CC2OC)C(O)C1OC |
|
GD121583 | -0.18 | 412.48 | C21H32O8 | C=C(COC1OC(CO)C(O)C(O)C1O)C1CCC2(C)CC(O)C(=O)C(C)=C2C1 |
|
GD121584 | 2.23 | 991.13 | C51H74O19 | COc1ccc(C(=O)OC2C(OC(=O)C34CCC(C)(C)CC3C3=CCC5C6(C)CCC(OC7OC(C(=O)O)C(O)C(O)C7O)C(C)(CO)C6CCC5(C)C3(C)CC4O)OC(CO)C(O)C2O)cc1OC |
|
GD121585 | 0.37 | 410.46 | C21H30O8 | C=C(C(=O)OC1OC(CO)C(O)C(O)C1O)C1CC(=O)C2(C)CCCC(C)=C2C1 |
|
GD121586 | -0.2 | 858.83 | C43H44O16N3 | Cc1cc(C)cc(C2=C3N=CC=C3CN2OC2C(Oc3ccc4c(=O)c(-c5ccc(O)cc5)coc4c3)OC(C(O)(CO)OC(=O)C([NH2+]CCC=O)C(=O)O)C(O)C2(O)CO)c1 |
|
GD121587 | -0.89 | 466.4 | C21H22O12 | O=C(O)C1OC(Oc2cc(O)c3c(c2)OC(c2ccc(O)c(O)c2)C(O)C3)C(O)C(O)C1O |
|
GD121588 | 0.66 | 460.44 | C23H24O10 | COc1c(OC2OC(CO)C(O)C(O)C2O)cc2oc(-c3ccccc3)cc(=O)c2c1OC |
|
GD121589 | 2.23 | 330.42 | C17H30O6 | CC1OC(OCCCCCCCCC=CC(=O)O)C(O)CC1O |
|
GD121590 | 0.53 | 957.16 | C49H80O18 | CC1OC(OC2C(CO)OC(OCC3OC(OC(=O)C45CCC(C)(C)CC4C4=CCC6(C)C7(C)CCC(O)C(C)(CO)C7CCC6(C)C4(C)CC5)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O |
|
GD121591 | -2.81 | 704.72 | C32H48O17 | CC=C1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)OC3CC(C(C)COC4OC(CO)C(O)C(O)C4O)C(COC(=O)CC21)C3C |