aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD16711 | -0.08 | 382.41 | C19H26O8 | CC(=CCO)CCC=C(C)C(=O)OC1C2OC2(CO)C2C(O)OC=CC12O |
|
AD16712 | 11.59 | 635.03 | C40H74O5 | CCCCCCCCC=CCCCCCCCC(=O)OC(CO)COC(=O)CCCCCCCC1CC1CCCCCCCC |
|
AD16713 | 3.08 | 348.44 | C20H28O5 | C=C1CCC2C(C)(CCC(O)C2(C)C(=O)O)C1CCC1=CCOC1=O |
|
AD16714 | 0.0 | 70.09 | C4H6O | CC#CCO |
|
AD16715 | 3.31 | 214.19 | C11H9OF3 | CC(=O)C=Cc1ccc(C(F)(F)F)cc1 |
|
AD16716 | 2.84 | 372.34 | C20H12O4N4 | NN1C(=O)c2c(c3c4cccc(O)c4[nH]c3c3[nH]c4c(O)cccc4c23)C1=O |
|
AD16717 | -0.75 | 170.1 | C5H4O4N3 | COC(=O)C1=C([N+](=O)[O-])N=C[N]1 |
|
AD16718 | 1.9 | 404.42 | C21H24O8 | CC=C1C(O)OC=C(C(=O)OC)C1CC(=O)OCCc1ccc2c(c1)OCCO2 |
|
AD16719 | 2.09 | 332.35 | C18H20O6 | CC=C1C(O)OC=C(C(=O)OC)C1CC(=O)OCc1ccccc1 |
|
AD16720 | 2.22 | 185.19 | C10H7ON3 | c1cc2cc(-c3ncon3)ccc2[nH]1 |