aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD44241 | 1.09 | 192.17 | C9H8O3N2 | NC(=O)C=Cc1cccc([N+](=O)[O-])c1 |
|
AD44242 | 0.87 | 237.25 | C12H15O4N | COc1cc(C(=O)N2CCOCC2)ccc1O |
|
AD44243 | 0.89 | 418.49 | C23H30O7 | CC12CCC(O)CC1CC1OC13C2C(O)C(=O)C1(C)C(C2=CC(=O)OC2)CCC13O |
|
AD44244 | 2.75 | 348.48 | C21H32O4 | CC12CC(=O)C3C(CCC4CC(O)CCC43C)C1CCC2C(=O)CO |
|
AD44245 | 2.29 | 390.43 | C21H26O7 | COC(=O)C1=CC(O)CC2C1(C)CCC1(O)C(=O)OC(c3ccoc3)CC21C |
|
AD44246 | 1.55 | 200.03 | C7H6ONBr | NC(=O)c1ccc(Br)cc1 |
|
AD44247 | 2.22 | 340.42 | C18H28O6 | OCC1OC2OC3(CCCCC3)OC2C2OC3(CCCCC3)OC12 |
|
AD44248 | 2.72 | 354.31 | C19H14O7 | COC(=O)c1oc2cc(O)ccc2c(=O)c1-c1ccc2c(c1)OCCO2 |
|
AD44249 | 3.09 | 372.42 | C21H24O6 | COC(=O)C1=CCCC2C3(C)CC(c4ccoc4)OC(=O)C3=CC(O)C12C |
|
AD44250 | 2.27 | 414.57 | C25H36O4N | COC12CCC3(CC1C(C)(O)C(C)(C)C)C1Cc4ccc(O)c5c4C3(CC[NH2+]1)C2O5 |