aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD04871 | 1.22 | 427.39 | C19H26O8NP | CN(CCc1ccc(CCOP(=O)(O)O)cc1)C(=O)C1C2CCC(O2)C1C(=O)O |
|
AD04872 | 3.01 | 321.7 | C13H17O5NPCl | CCOC(=O)C(C)NP(=O)(OC)Oc1ccc(Cl)cc1 |
|
AD04873 | 1.9 | 592.79 | C29H52O10S | CC(C)C(CCO)CCC(C)C1C(O)C(O)C2C1(C)CCC1C3(C)CCC(O)C(O)C3C(OS(=O)(=O)O)CC12O |
|
AD04874 | 2.94 | 874.11 | C45H72O9N7F | COc1c(N2CC3CCCN(CCCCCCCCCCCCOC4C(O)C(N)CC(N)C4OC4OC(CN)C(O)CC4N)C3C2)c(F)cc2c(=O)c(C(=O)O)cn(C3CC3)c12 |
|
AD04875 | 0.0 | 217.21 | C9H9ON6 | CN(C)c1cn2c(=O)c3c(nc2[nH]1)[N]C=N3 |
|
AD04876 | 1.95 | 218.16 | C11H6O5 | O=c1ccc2c(O)c(O)c3occc3c2o1 |
|
AD04877 | 2.55 | 142.2 | C7H7FS | CSc1ccccc1F |
|
AD04878 | 2.89 | 132.27 | C7H16S | CCCCCCCS |
|
AD04879 | 1.82 | 226.32 | C13H22O3 | CC1=CC(=O)CC(C)(C)C1(O)CCC(C)O |
|
AD04880 | 3.06 | 246.17 | C10H12O4FP | COP1(=O)OCCC(c2cccc(F)c2)O1 |