aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD11461 | -1.31 | 544.69 | C25H48O7N6 | CC(N)C(=O)NC(CCC(N)=O)C(=O)NC(CCC(=O)NCCCCCCO)C(=O)NCCCCCCO |
|
AD11462 | -1.94 | 253.26 | C7H13O6N2S | CNC(=O)CN(CCOS(=O)(=O)[O-])C(C)=O |
|
AD11463 | 1.18 | 365.47 | C15H29O6N2S | CCN(CC(=O)NC)C(=O)CCCCCCCCCOS(=O)(=O)[O-] |
|
AD11464 | 0.42 | 386.4 | C20H22O6N2 | C=CC1C(O)OC=C2C(=O)N(CCC3(O)C(=O)Nc4ccccc43)C(O)CC21 |
|
AD11465 | 1.36 | 301.09 | C9H8ON3I | OCc1nnn(-c2ccccc2)c1I |
|
AD11466 | 2.35 | 331.42 | C18H25O3N3 | CNC(=O)CCCCCCCC(=O)Nc1cccc2c1CNC2=O |
|
AD11467 | 3.16 | 811.88 | C45H49O13N | CC(=O)OC12COC1CC(O)C1(C)C(=O)C(O)C3=C(C)C(OC(=O)C(O)C(NC(=O)c4ccccc4)c4ccccc4)CC(O)(C(OC(=O)c4ccccc4)C21)C3(C)C |
|
AD11468 | 2.63 | 379.14 | C12H8ON6I | O=C(Nc1ccc(I)cc1)Nc1ncnc2c1N=C[N]2 |
|
AD11469 | 5.62 | 516.72 | C31H48O6 | C=C(C)C1CCC2(C(=O)O)CCC3(C)C(CC(O)C4C5(C)C(CC(=O)OC)OC(C)(C)C5CCC43C)C12 |
|
AD11470 | 4.84 | 257.34 | C19H15N | c1ccc2cc(Cn3ccc4ccccc43)ccc2c1 |