aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD13811 | 4.64 | 274.79 | C18H19OCl | CCc1ccc(Cc2ccc(COC)cc2Cl)cc1 |
|
AD13812 | 1.66 | 274.27 | C15H14O5 | Cc1cc(=O)c2c(O)cc3c(c2o1)CC=C(CO)CO3 |
|
AD13813 | 2.59 | 330.29 | C17H14O7 | COc1cc(O)c2c(=O)c(O)c(-c3ccc(O)c(OC)c3)oc2c1 |
|
AD13814 | -1.05 | 166.14 | C6H6O2N4 | Cn1cnc2c(=O)[nH]c(=O)[nH]c21 |
|
AD13815 | 7.29 | 1513.84 | C78H76O19N9Cl3 | CNC(CC(C)C)C(=O)NC1C(=O)NC(CC(N)=O)C(=O)NC2C(=O)NC3C(=O)NC(C(=O)NC(C(=O)O)c4cc(O)cc(O)c4-c4cc3ccc4O)C(OC3CC(C)(NCc4ccc(C=Cc5ccc(Cl)cc5)cc4)C(O)C(C)O3)c3ccc(c(Cl)c3)Oc3cc2cc(c3O)Oc2ccc(cc2Cl)C1O |
|
AD13816 | 2.9 | 834.11 | C44H75O10N5 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)CN(CCCN(CCC#N)C(=O)NCCc2ccccc2)C(C)C(O)C1(C)O |
|
AD13817 | 2.27 | 601.78 | C31H55O10N | CCC(O)C(C)(O)C1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2OC(C)=O)C2(C)CC(C)C(O2)C1C |
|
AD13818 | 0.31 | 99.13 | C5H9ON | C=C(C)CNC=O |
|
AD13819 | 3.75 | 472.62 | C28H40O6 | CC(C)=CCC(O)C(C)(O)C1C(O)CC2(C)C3CCc4cc(O)c(O)cc4C3(C)C(=O)CC12C |
|
AD13820 | 1.36 | 262.26 | C14H14O5 | CC(C)(O)C1Oc2ccc3ccc(=O)oc3c2C1O |