aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD14711 | 3.93 | 512.69 | C26H42O7NS | CC(=O)OC1CC2C(CCC3CC(OS(=O)(=O)[O-])CCC32C)C2CCC(C(C)CCC(N)=O)C12C |
|
AD14712 | 0.42 | 619.79 | C31H57O11N | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C3COC3)C2O)C(C)(O)CC(C)C(O)C(C)C(O)C1(C)O |
|
AD14713 | 1.68 | 619.84 | C32H61O10N | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)CC(C)C)C2O)C(C)(O)CC(C)C(O)C(C)C(O)C1(C)O |
|
AD14714 | -2.3 | 414.37 | C17H22O10N2 | O=C(O)NC1C(O)CC(O)(C(=O)O)OC1C(O)C(O)CNC(=O)c1ccccc1 |
|
AD14715 | 4.29 | 512.71 | C27H44O7S | CC(C)CC1OC1C(C)(O)C1CCC2C3CC(O)C4CC(OS(=O)(=O)O)CCC4(C)C3=CCC21C |
|
AD14716 | 0.78 | 144.22 | C4H4N2S2 | NC(=S)c1cscn1 |
|
AD14717 | 2.0 | 332.26 | C16H12O8 | COc1cc2oc(-c3ccc(O)c(O)c3)c(O)c(=O)c2c(O)c1O |
|
AD14718 | 0.75 | 151.16 | C8H9O2N | CNC(=O)c1ccccc1O |
|
AD14719 | 1.5 | 243.24 | C10H14O3N3F | CCC(C)COC(=O)Nc1nc(=O)[nH]cc1F |
|
AD14720 | 1.43 | 294.2 | C11H7O5N4F | O=C(Nc1nc(=O)[nH]cc1F)Oc1ccc([N+](=O)[O-])cc1 |