aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD05041 | 6.28 | 1016.2 | C53H61O15NS2 | CC(=O)OC1C(=O)C2(C)C(O)CC3OCC3(OC(C)=O)C2C(OC(=O)c2ccccc2)C2(O)CC(OC(=O)C(OC(=O)C(C)(C)CCSS)C(NC(=O)c3ccccc3)c3ccccc3)C(C)=C1C2(C)C |
|
AD05042 | 3.07 | 263.2 | C12H6N4F3 | FC(F)(F)c1cccc(-c2ncnc3c2N=C[N]3)c1 |
|
AD05043 | 5.9 | 470.69 | C30H46O4 | CC1(C)CCC23CCC4(C)C5(C)CCC6C(C)(C)C(O)CCC6(C)C5C5OC5C4(OC2=O)C3C1 |
|
AD05044 | -0.46 | 110.1 | C4H4ON3 | CC(=O)C1=N[N]C=N1 |
|
AD05045 | 0.85 | 445.96 | C2H11O16P5 | COP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)OC |
|
AD05046 | 6.94 | 583.85 | C36H57O5N | CCC(C)C(NC(=O)C1(C)CCC2(C)CCC3(C)C(=CC(=O)C4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1)C(=O)O |
|
AD05047 | 0.23 | 159.18 | C7H13O3N | CCC(C)C(NC=O)C(=O)O |
|
AD05048 | 2.7 | 190.27 | C10H10N2S | Cc1ccc(-c2cnc(N)s2)cc1 |
|
AD05049 | -0.83 | 331.23 | C10H14O6N5P | Nc1ncnc2c1ncn2C1CC(O)C(COP(=O)(O)O)O1 |
|
AD05050 | 0.68 | 191.21 | C9H11ON4 | COC(C)C1=C[N]c2ncnc(N)c21 |