aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD08131 | 3.66 | 446.63 | C27H42O5 | CC1COC2(OC3CC4C5CC=C6CC(O)CCC6(C)C5CCC4(C)C3C2C)C(O)C1O |
|
AD08132 | 9.94 | 606.89 | C39H58O5 | CCC=CCC=CCC=CCC=CCC=CCC(=O)OCC(CO)OC(=O)CCCCC=CCC=CCC=CCC=CCC |
|
AD08133 | -5.0 | 746.67 | C28H43O14N8P | Cc1cn(C2CC(O)C(COP(=O)(O)OC3CC(n4cc(C)c(=O)[nH]c4=O)OC3C(=O)NCCNC3C(O)C(N)CC(N)C3O)O2)c(=O)[nH]c1=O |
|
AD08134 | 3.98 | 343.32 | C20H10O2N3F | O=C1NC(=O)c2c1c1c3ccccc3[nH]c1c1[nH]c3ccc(F)cc3c21 |
|
AD08135 | 1.59 | 269.29 | C13H13ON6 | COc1ccc(CNc2nc(N)nc3c2N=C[N]3)cc1 |
|
AD08136 | 2.66 | 357.41 | C20H23O5N | CCN1C=C(C(=O)O)Cc2cc(C#CCOCCCCC(=O)O)ccc21 |
|
AD08137 | -0.63 | 212.21 | C6H6O2N5S | CS(=O)(=O)c1nc(N)nc2c1N=C[N]2 |
|
AD08138 | 1.01 | 548.59 | C28H36O11 | COC(=O)C12OCC34C(CC5C(C)C(=O)C(O)=CC5(C)C3C(O)C1O)OC(=O)C(OC(=O)C=C(C)C(C)C)C24 |
|
AD08139 | 2.04 | 276.36 | C14H16O2N2S | CCOC(=O)C1=C(C)NC(=S)NC1c1ccccc1 |
|
AD08140 | 2.85 | 228.25 | C14H12O3 | COC(=O)c1cccc(-c2ccc(O)cc2)c1 |