aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD12851 | 1.58 | 259.2 | C10H14O5NP | COC(=O)CNP(=O)(OC)Oc1ccccc1 |
|
AD12852 | 2.83 | 660.93 | C35H68O9N2 | CCCCCCNC1C(C)CC(C)(O)C(OC2OC(C)CC(N(C)C)C2O)C(C)C(O)C(C)C(=O)OC(CC)C(C)(O)C(O)C1C |
|
AD12853 | 1.51 | 646.79 | C32H50O8N6 | CCC(C)C(NC(=O)C(NC(=O)C(NC(=O)CCCCC(N)Cc1ccc(OC)cc1)C(O)c1c[nH]c(=O)[nH]1)C(C)CC)C(=O)O |
|
AD12854 | 3.0 | 261.35 | C14H15O2NS | CNC(=O)c1sccc1OCc1ccc(C)cc1 |
|
AD12855 | 3.89 | 286.33 | C19H14ON2 | Cc1ccc(-c2cc(-c3ccccc3)c(C#N)c(=O)[nH]2)cc1 |
|
AD12856 | 0.4 | 179.16 | C7H7O2N4 | COc1nc2c(c(OC)n1)N=C[N]2 |
|
AD12857 | 2.84 | 241.04 | C8H5O2N2Br | O=[N+]([O-])c1cc2[nH]ccc2cc1Br |
|
AD12858 | 1.97 | 557.73 | C29H51O9N | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C2(C)CC(C)=C(O2)C(C)C(O)C1(C)O |
|
AD12859 | -0.48 | 141.13 | C5H7O2N3 | COc1cn[nH]c1C(N)=O |
|
AD12860 | 5.62 | 1031.08 | C56H58O17N2 | CC(=O)OC1C(=O)C2(C)C(O)CC3OCC3(OC(C)=O)C2C(OC(=O)c2ccccc2)C2(O)CC(OC(=O)C(OC(=O)Cc3ccc(NC(=O)O)cc3)C(NC(=O)c3ccccc3)c3ccccc3)C(C)=C1C2(C)C |