aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD01041 | 1.18 | 398.37 | C21H18O8 | COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)CC(O)(C(C)=O)CC3O |
|
AD01042 | 4.78 | 824.92 | C43H56O14N2 | COC(=O)NC1C(C)OC(OC2CC=C(C)C3C=CC4C(O)C(C)CC(C)C4C3(C)C(O)=C3C(=O)OC4(CC(C=O)=CC(OC(C)=O)C4C=C2C)C3=O)CC1(C)[N+](=O)[O-] |
|
AD01043 | 1.49 | 122.17 | C8H10O | Cc1ccc(CO)cc1 |
|
AD01044 | 10.4 | 568.92 | C35H68O5 | CCCCCCCCCCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCCCCCCCCCC |
|
AD01045 | 2.33 | 158.2 | C11H10O | OCc1ccc2ccccc2c1 |
|
AD01046 | 2.88 | 284.27 | C16H12O5 | COc1cc(O)cc2oc(-c3ccc(O)cc3)cc(=O)c12 |
|
AD01047 | 0.8 | 274.29 | C11H8O2N5S | Nc1nc(S(=O)(=O)c2ccccc2)nc2c1N=C[N]2 |
|
AD01048 | 7.88 | 548.66 | C23H50O8P2S | CCCCCCCCCCCCCCCCCCSCC(COP(=O)(O)OP(=O)(O)OC)OC |
|
AD01049 | 6.06 | 472.71 | C30H48O4 | C=C(C)C1CCC2(C(=O)O)CCC3(C)C(CCC4C5(C)CCC(O)C(C)(CO)C5CCC43C)C12 |
|
AD01050 | 4.22 | 377.31 | C20H9O3N3F2 | O=C1c2c(c3c4cc(F)ccc4[nH]c3c3[nH]c4ccc(F)cc4c23)C(=O)N1O |