aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD08971 | 0.42 | 311.32 | C12H13O5N3S | O=CNCCCOc1nonc1S(=O)(=O)c1ccccc1 |
|
AD08972 | -0.49 | 620.78 | C30H56O11N2 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)CC(N)=O)C2O)C(C)(O)CC(C)C(O)C(C)C(O)C1(C)O |
|
AD08973 | 1.55 | 197.56 | C7H2O2N4Cl | O=[N+]([O-])c1cc(Cl)nc2c1N=C[N]2 |
|
AD08974 | 0.93 | 177.27 | C7H15O2NS | CSCCCCC(N)C(=O)O |
|
AD08975 | 2.5 | 586.79 | C31H56O9N | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC([N+](C)(C)CC)C2O)C2(C)CC(C)=C(O2)C(C)C(O)C1(C)O |
|
AD08976 | 2.58 | 214.35 | C13H26O2 | CC(O)CCC1C(C)CC(O)CC1(C)C |
|
AD08977 | 0.4 | 230.3 | C12H22O4 | CC1CC(O)CC(C)(C)C1(O)C=CC(O)O |
|
AD08978 | 3.19 | 253.33 | C14H11N3S | c1ccc(Cc2nnc(-c3cccnc3)s2)cc1 |
|
AD08979 | 5.66 | 470.69 | C30H46O4 | CC12CCC3(COC1=O)C(O)CC1(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC41C)C3C2 |
|
AD08980 | 5.06 | 502.52 | C28H26O7N2 | Cc1oc(-c2ccccc2)nc1CCOc1ccc(CN(CC(=O)O)C(=O)Oc2ccc(O)cc2)cc1 |