aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD00061 | 3.55 | 379.35 | C18H22O6NP | COc1ccc(OP(=O)(NC(C)C(=O)OCc2ccccc2)OC)cc1 |
|
AD00062 | 3.28 | 388.45 | C21H16O2N4S | NCc1nc(-c2ccc3[nH]c4c5c(c6c(c4c3c2)C(=O)NC6=O)CCC5)cs1 |
|
AD00063 | 1.66 | 509.74 | C26H51O3N7 | C[N+](C)(C)CCCC(=O)NCCOC1CCCCCc2c1nnn2CCNC(=O)CCC[N+](C)(C)C |
|
AD00064 | 4.16 | 318.46 | C20H30O3 | C=C1CC23CCC4C(C)(C(=O)O)CCCC4(C)C2CCC1(O)C3 |
|
AD00065 | 4.68 | 214.39 | C14H30O | CCCCCCCCCCCCCCO |
|
AD00066 | 1.56 | 102.18 | C6H14O | CCCCCCO |
|
AD00067 | 0.41 | 248.24 | C12H12O4N2 | CCC1(c2ccc(O)cc2)C(=O)NC(=O)NC1=O |
|
AD00068 | -0.14 | 205.02 | C2H7O7P2 | COP(=O)([O-])OP(=O)(O)OC |
|
AD00069 | -0.4 | 123.13 | C6H7ON2 | NC(=O)c1ccc[nH+]c1 |
|
AD00070 | 9.56 | 537.91 | C34H67O3N | CCCCCCCCCCCCCC=CC(O)C(CO)NC(=O)CCCCCCCCCCCCCCC |