aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD16511 | 3.17 | 238.24 | C15H10O3 | O=c1cc(-c2ccccc2)oc2cc(O)ccc12 |
|
AD16512 | 6.21 | 472.71 | C30H48O4 | CC1(CO)CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1 |
|
AD16513 | -2.11 | 224.18 | C7H8O3N6 | NC(=O)Cn1c(=O)[nH]c2nc(N)nc(O)c21 |
|
AD16514 | 1.07 | 126.11 | C6H6O3 | COC(=O)c1ccoc1 |
|
AD16515 | 0.98 | 112.08 | C5H4O3 | O=C(O)c1ccoc1 |
|
AD16516 | -0.56 | 208.28 | C7H16O3N2S | CCC(C)C(N)C(=O)NS(C)(=O)=O |
|
AD16517 | 3.53 | 752.0 | C40H69O10N3 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)CN(C)C(C)C(OC(=O)NCc2ccc(C)c(C)c2)C1(C)O |
|
AD16518 | -3.64 | 413.36 | C17H21O10N2 | O=C(O)NC1C(O)CC(O)(C(=O)[O-])OC1C(O)C(O)CNC(=O)c1ccccc1 |
|
AD16519 | 3.3 | 231.08 | C12H8O2Cl2 | CC(=O)C=Cc1cc(Cl)cc(Cl)c1O |
|
AD16520 | -1.51 | 256.21 | C11H12O7 | COC(=O)C1=COC(O)C2C1C1OC1C21OC1O |