aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD04751 | 3.66 | 446.63 | C27H42O5 | CC1COC2(CC1O)OC1CC3C4CC=C5CC(O)CC(O)C5(C)C4CCC3(C)C1C2C |
|
AD04752 | 2.05 | 320.38 | C18H18ON5 | O=C(CNc1ncnc2c1C(c1ccccc1)=C[N]2)NCC1CC1 |
|
AD04753 | 3.41 | 211.35 | C13H25ON | CCC(C)CCCCCCC=CC(N)=O |
|
AD04754 | 2.38 | 334.46 | C20H30O4 | C=CC1(C)CCC2=C(C1)C(=O)CC1C2(C)CC(O)C(O)C1(C)CO |
|
AD04755 | -0.51 | 119.16 | C4H7O2S | CSC(C)C(=O)[O-] |
|
AD04756 | 0.99 | 318.33 | C17H18O6 | OCC12OC1C(OC=Cc1ccc(O)cc1)C1C=COC(O)C12 |
|
AD04757 | 1.03 | 274.05 | C6H5N5I | CNc1nc(I)nc2c1N=C[N]2 |
|
AD04758 | 1.75 | 246.78 | C13H23ON2Cl | CC(C)CCC1CNC1C(=O)NCC(C)Cl |
|
AD04759 | 2.1 | 223.34 | C12H17ONS | CSCCCNC(=O)Cc1ccccc1 |
|
AD04760 | 2.74 | 494.71 | C29H50O6 | CC(C)C(C=CC(C)C1C(O)C(O)C2C3CC(O)C4C(O)C(O)CCC4(C)C3CCC12C)CCO |