aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD11171 | 2.41 | 272.26 | C15H12O5 | O=C(C=Cc1ccc(O)cc1)c1cc(O)cc(O)c1O |
|
AD11172 | 2.31 | 360.45 | C21H28O5 | CC1OC(=O)C=C1C1(C)CCC2C(CC=C3CC(O)C(O)CC32C)C1=O |
|
AD11173 | 1.3 | 236.26 | C13H10N5 | C1=NC2=C(N=C[N]2)C2=NC(c3ccccc3)CN12 |
|
AD11174 | 2.6 | 447.55 | C25H35O7 | C=C1CC23CCC4C(C)(C(=O)OC(CCC(=O)[O-])C(=O)O)CCCC4(C)C2CCC1(O)C3 |
|
AD11175 | 5.57 | 572.83 | C35H56O6 | CC(C)=CC(=O)OC1CC(C)(C)CC2C3=CCC4C5(C)CCC(O)C(C)(C)C5CCC4(C)C3(C)C(O)C(O)C12CO |
|
AD11176 | 4.93 | 402.56 | C22H36O2N5 | CCCCCCCCCCCCCCCCNc1nc(=O)c2c(c(=O)[nH]1)[N]C=N2 |
|
AD11177 | 1.22 | 256.25 | C12H10O2N5 | Nc1nc(O)c2c(n1)[N]C(OCc1ccccc1)=N2 |
|
AD11178 | 6.01 | 472.71 | C30H48O4 | COC1CC(C(C)CC(=O)C=C(C)C)C2(C)CCC3(O)C(=C12)CCC1C(C)(C)C(O)CCC13C |
|
AD11179 | 7.19 | 452.74 | C28H54O3N | CCCCCCCCCCCCCCCC(=O)N(C)CCCCCCCCCCC(=O)[O-] |
|
AD11180 | 1.19 | 424.53 | C23H36O7 | CC(=O)OC1CC2C3(C)CCC(O)CC3=CCC2(O)C2(O)CCC(O)(C(C)O)C12C |