aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD04811 | 5.17 | 613.79 | C35H51O8N | CCC(C)C1OC2(CCC1C)CC1CC(CC=C(C)C(O)C(C)C=CC=C3COC4C(=NOC)C(C)=CC(C(=O)O1)C34O)O2 |
|
AD04812 | 1.12 | 179.17 | C9H9O3N | CON=C(C(=O)O)c1ccccc1 |
|
AD04813 | 0.5 | 415.49 | C22H29O5N3 | O=c1ccn(C2OC(C(O)CN3CCC(Cc4ccccc4)CC3)CC2O)c(=O)[nH]1 |
|
AD04814 | 2.05 | 213.32 | C11H17O2S | COc1ccccc1CC[S+](C)OC |
|
AD04815 | 3.61 | 529.72 | C31H47O6N | CCC1OC(=O)CC(O)C(C)C(O)C(CCNCCc2ccccc2)CC(C)C(=O)C=CC(C)=CC1CO |
|
AD04816 | 0.84 | 164.23 | C6H12O3S | COCCCSCC(=O)O |
|
AD04817 | 0.19 | 150.2 | C5H10O3S | O=C(O)CSCCCO |
|
AD04818 | 0.81 | 165.24 | C10H15ON | CNC(CO)Cc1ccccc1 |
|
AD04819 | -0.26 | 131.09 | C3H5O3N3 | [N-]=[N+]=NCC(O)C(=O)O |
|
AD04820 | 5.76 | 384.58 | C21H36O4S | CCC1C(=COS(=O)(=O)O)CCC2C1(C)CCC1C(C)(C)CCCC12C |