aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD03231 | 1.87 | 380.46 | C21H29O5F | CC12CCC(=O)C=C1CCC1C3CCC(O)(C(=O)CO)C3(C)CC(O)C12F |
|
AD03232 | 1.04 | 568.66 | C29H44O11 | CCC1OC(=O)CC(O)C(C)C(OC2OC(C)C(O)C(=O)C2O)C(CC=O)CC(C)C(=O)C=CC(C)=CC1CO |
|
AD03233 | -2.28 | 316.4 | C14H28O4N4 | CCNC1CC(N)C(OC2OC(CN)=CCC2N)C(O)C1O |
|
AD03234 | 3.98 | 395.41 | C22H21O6N | CC(C)=CCc1cc(C(=O)Nc2c(O)c3ccc(O)c(C)c3oc2=O)ccc1O |
|
AD03235 | 0.96 | 621.65 | C30H35O8N7 | CNC(=O)C(CNC(=O)C(N)Cc1ccc([N+](=O)[O-])cc1)NC(=O)C(Cc1ccc(O)cc1)NC(=O)Nc1ccc(OC)cc1 |
|
AD03236 | 7.11 | 546.83 | C34H58O5 | CCCCCCCCCCCCOC(=O)C(C)C1(O)C(O)CC2C3CC=C4CC(O)CCC4(C)C3CCC21C |
|
AD03237 | 0.84 | 196.2 | C10H12O4 | COc1ccc(C(=O)OCCO)cc1 |
|
AD03238 | 1.79 | 284.34 | C15H18ON5 | Nc1nc(C#CC2(O)CCCCCCC2)nc2c1N=C[N]2 |
|
AD03239 | 4.38 | 608.71 | C31H30O3N9S | COc1ccc(NC(S)=NCCNC(=O)Cc2ccc(NC(=O)Cc3ccc(Nc4ncnc5c4N=C[N]5)cc3)cc2)cc1 |
|
AD03240 | -0.4 | 800.98 | C37H72O16N2 | CCC1CC(C(=O)NCCNC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOC)CC(O)C1O |