aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD44471 | 1.62 | 193.2 | C10H11O3N | COc1cc(C=N)ccc1OC(C)=O |
|
AD44472 | 2.16 | 419.52 | C23H33O6N | CC12CCC3C(CCC4(O)CC(O)CCC34C=NO)C1(O)CCC2C1=CC(=O)OC1 |
|
AD44473 | 3.12 | 444.62 | C26H40O4N2 | OCC(OC(O)C=NC12CC3CC(CC(C3)C1)C2)C(O)C=NC12CC3CC(CC(C3)C1)C2 |
|
AD44474 | 0.98 | 180.2 | C10H12O3 | C=CC1C2=CCOCC2=COC1O |
|
AD44475 | 1.76 | 447.57 | C25H37O6N | CC12CCC3C(CCC4(O)CC(O)CCC34C=NCCO)C1(O)CCC2C1=CC(=O)OC1 |
|
AD44476 | 2.6 | 296.33 | C17H16O3N2 | Cc1cccc(OCCN2C(=O)C(=NO)c3ccccc32)c1 |
|
AD44477 | 2.6 | 296.33 | C17H16O3N2 | Cc1ccccc1OCCN1C(=O)C(=NO)c2ccccc21 |
|
AD44478 | 2.41 | 252.27 | C15H12O2N2 | O=C1C(=NO)c2ccccc2N1Cc1ccccc1 |
|
AD44479 | 2.95 | 417.84 | C21H14ON8Cl | Nc1ncnc2c1NC(=NN=C1C(=O)c3ccccc3N1Cc1ccc(Cl)cc1)[N]2 |
|
AD44480 | 4.14 | 454.61 | C28H38O5 | CC1=C(CO)C(=O)OC(C(C)C2CCC3C4C(O)C=C5CC=CC(=O)C5(C)C4CCC23C)C1 |