aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD18661 | -1.36 | 616.55 | C21H42O11N6P2 | COP(=O)(O)OC1C(COP(=O)(O)O)OC(n2cc(C)c(=O)[nH]c2=O)C1NCCCNCCCCNCCCN |
|
AD18662 | 8.78 | 627.91 | C40H57O3N3 | Cc1ccccc1-n1cc(COC(=O)C23CCC(C)(C)CC2C2=CCC4C5(C)CCC(O)C(C)(C)C5CCC4(C)C2(C)CC3)nn1 |
|
AD18663 | 8.61 | 631.88 | C39H54O3N3F | CC1(C)CCC2(C(=O)OCc3cn(-c4cccc(F)c4)nn3)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1 |
|
AD18664 | 3.19 | 362.4 | C18H18O6S | C=CCc1ccc(OS(=O)(=O)O)c(-c2cc(C(O)C=C)ccc2O)c1 |
|
AD18665 | 4.52 | 280.37 | C19H20O2 | C=CCc1ccc(O)c(-c2cc(CC=C)ccc2OC)c1 |
|
AD18666 | 0.09 | 105.11 | C4H8ONF | O=CNCCCF |
|
AD18667 | -1.53 | 159.1 | C4H5O4N3 | O=C1NCC([N+](=O)[O-])C(=O)N1 |
|
AD18668 | 1.59 | 166.22 | C10H14O2 | OCOCCCc1ccccc1 |
|
AD18669 | 2.09 | 242.29 | C11H8N5S | Nc1ncnc2c1N=C(Sc1ccccc1)[N]2 |
|
AD18670 | 1.82 | 479.49 | C25H25O7N3 | CCC1(OC(=O)NCCOCCO)C(=O)OCc2c1cc1n(c2=O)Cc2cc3ccccc3nc2-1 |