aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD03921 | 2.38 | 245.23 | C13H11O4N | O=[N+]([O-])c1cccc(C(O)c2ccc(O)cc2)c1 |
|
AD03922 | 2.89 | 284.31 | C17H16O4 | O=C(O)CCC(=O)c1ccc(-c2cccc(CO)c2)cc1 |
|
AD03923 | 7.38 | 527.83 | C31H61O5N | CCCCCCCCCCCCCC(=O)OC(CCCCCCCCCCC)CC(=O)NC(CO)CO |
|
AD03924 | 5.6 | 1323.21 | C69H65O16N9Cl2 | CNC(CC(C)C)C(=O)NC1C(=O)NC(CC(N)=O)C(=O)NC2C(=O)NC3C(=O)NC(C(=O)NC(C(=O)NCc4ccc(-c5ccc(C)cc5)cc4)c4cc(O)cc(O)c4-c4cc3ccc4O)C(O)c3ccc(c(Cl)c3)Oc3cc2cc(c3O)Oc2ccc(cc2Cl)C1O |
|
AD03925 | 12.13 | 624.09 | C40H81O3N | CCCCCCCCCCCCCCCCCCCCCC(=O)NC(CO)C(O)CCCCCCCCCCCCCCC |
|
AD03926 | 5.18 | 513.48 | C25H22O4N5F3 | CCCC(C)OC(=O)c1cnn(-c2ccc(-n3cc(-c4cccc(C(=O)O)c4)nn3)cc2)c1C(F)(F)F |
|
AD03927 | -0.07 | 270.99 | CH8O9NP3 | COP(=O)(O)OP(=O)(O)OP(N)(=O)O |
|
AD03928 | 2.45 | 226.24 | C12H10ON4 | C=Nc1n[nH]c2nc3cc(OC)ccc3cc12 |
|
AD03929 | 0.93 | 255.28 | C13H13ON5 | C[N+]1=C[N]c2nc(NCc3ccccc3)[nH]c(=O)c21 |
|
AD03930 | -0.57 | 480.47 | C23H28O11 | COC(=O)C12OCC34C(CC5C(C)C(=O)C(O)=CC5(C)C3C(O)C1O)OC(=O)C(OC(C)=O)C24 |