aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD13061 | 2.65 | 553.72 | C28H43O8NS | CCOC(=O)C1CSC(=CCC2CCC(O)C(C)C(O)CC(=O)OC(CC)C(CO)C=C(C)C=CC2=O)N1 |
|
AD13062 | -0.02 | 285.0 | C2H8O10P3 | COP(=O)(O)OP(=O)([O-])OP(=O)(O)OC |
|
AD13063 | 1.87 | 240.21 | C14H8O4 | O=C1c2ccccc2C(=O)c2c(O)ccc(O)c21 |
|
AD13064 | 2.47 | 398.07 | C6H13O9F4P3 | COP(=O)(O)OP(=O)(O)C(F)(F)CCCC(F)(F)P(=O)(O)O |
|
AD13065 | 1.68 | 332.37 | C14H14O3N5S | O=S(=O)(O)c1ccc(CCCNc2ncnc3c2N=C[N]3)cc1 |
|
AD13066 | 1.79 | 628.97 | C12H14O3N3I3 | CNC(=O)c1c(I)c(N)c(I)c(N(CCO)C(C)=O)c1I |
|
AD13067 | 0.67 | 181.15 | C7H7O3N3 | O=CNNc1ccc([N+](=O)[O-])cc1 |
|
AD13068 | 1.01 | 151.21 | C8H13N3 | C=Cn1cc(CNC)c(C)n1 |
|
AD13069 | 0.92 | 293.27 | C13H9ON8 | Nc1nc(-n2cc(-c3ccc(O)cc3)nn2)nc2c1N=C[N]2 |
|
AD13070 | 0.99 | 150.19 | C6H4N3S | Sc1ncnc2c1C=C[N]2 |