aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD21421 | 2.5 | 454.56 | C24H38O8 | CCCC(=O)OC1C=CC=CCC(C)OC(=O)CC(O)C(OC)C(O)C(CC=O)CC1C |
|
AD21422 | 1.57 | 484.54 | C24H36O10 | COC1C(O)CC(=O)OC(C)CC=CC=CC(OC(=O)CCC(=O)O)C(C)CC(CC=O)C1O |
|
AD21423 | 2.03 | 272.29 | C12H7N5FS | CNc1nc(C#Cc2ccc(F)s2)nc2c1N=C[N]2 |
|
AD21424 | 5.87 | 1105.16 | C59H64O19N2 | CC(=O)OC1C(=O)C2(C)C(O)CC3OCC3(OC(C)=O)C2C(OC(=O)c2ccccc2)C2(O)CC(OC(=O)C(OC(=O)OCCN(C)C(=O)OCc3ccc(O)cc3)C(NC(=O)c3ccccc3)c3ccccc3)C(C)=C1C2(C)C |
|
AD21425 | -0.85 | 200.13 | C5H13O6P | COCC(CO)(OC)P(=O)(O)O |
|
AD21426 | 4.61 | 409.57 | C25H35O2N3 | C=C1CC23CCC4C(C)(C(=O)NNc5ccncc5)CCCC4(C)C2CCC1(O)C3 |
|
AD21427 | 2.95 | 253.39 | C14H27ON3 | CCCCCCCCCCn1cc(CCO)nn1 |
|
AD21428 | 2.2 | 220.15 | C9H7O3F3 | COC(=O)c1cccc(C(F)(F)F)c1O |
|
AD21429 | 3.96 | 442.6 | C27H38O5 | CC(C(=O)CCC(C)CO)=C1C(=O)CC2C3C(=O)C=C4CC(O)CCC4(C)C3CCC12C |
|
AD21430 | 1.52 | 270.29 | C15H14O3N2 | NC(=O)CN(C(=O)c1ccccc1)c1ccc(O)cc1 |