aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD22911 | 2.27 | 224.26 | C12H16O4 | CCOc1cc(OCC)cc(C(=O)OC)c1 |
|
AD22912 | 4.25 | 258.75 | C17H15OCl | CC1Cc2cc(Cc3ccccc3Cl)ccc2O1 |
|
AD22913 | 2.24 | 159.19 | C10H9ON | COc1ccc2cccnc2c1 |
|
AD22914 | 2.54 | 256.35 | C16H20ON2 | CN(CCCC(N)=O)Cc1ccc2ccccc2c1 |
|
AD22915 | 1.66 | 191.26 | C9H9N3S | NCc1ccc(-c2csnn2)cc1 |
|
AD22916 | 1.89 | 328.28 | C17H12O7 | COc1cc(O)c2c(c1)C(=O)c1cc(O)c(C(=O)O)c(C)c1C2=O |
|
AD22917 | 3.71 | 270.33 | C17H18O3 | CCOc1ccc(Cc2ccc3c(c2C)OCO3)cc1 |
|
AD22918 | -2.18 | 856.03 | C39H69O12N9 | CC(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(C)NC(=O)C(C)NC(=O)C1COC(C)(C)N1C(=O)C(NC(=O)C(N)C(C)O)C(C)C)C(C)C)C(C)C)C(C)C)C(=O)O |
|
AD22919 | 0.63 | 1529.6 | C65H92O20N24 | COCc1cn(CC2OC(n3cc(COCC(COCc4cn(C5OC(Cn6cc(COC)nn6)C6OC(C)(C)OC65)nn4)(COCc4cn(C5OC(Cn6cc(COC)nn6)C6OC(C)(C)OC65)nn4)COCc4cn(C5OC(Cn6cc(COC)nn6)C6OC(C)(C)OC65)nn4)nn3)C3OC(C)(C)OC23)nn1 |
|
AD22920 | 4.4 | 502.57 | C28H30O5N4 | CCCCc1nc(C(C)C)c(CC(=O)O)c(=O)n1Cc1ccc(-c2ccccc2-c2noc(=O)[nH]2)cc1 |