aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD12741 | 4.45 | 292.33 | C19H16O3 | Cc1ccc(-c2c(O)cc(-c3ccccc3)c(O)c2O)cc1 |
|
AD12742 | 1.73 | 630.78 | C31H54O11N2 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC3C2OC(=O)N3CC)C(C)(OC)CC(C)C(=O)NC(C)C(O)C1(C)O |
|
AD12743 | -0.85 | 97.09 | C5H5O2 | C#CCCC(=O)[O-] |
|
AD12744 | 0.36 | 397.22 | C10H17O8N5P2 | COP(=O)(O)OP(=O)(O)OCCCCn1c(N)nc2c(=O)[nH]cnc21 |
|
AD12745 | -0.95 | 239.29 | C8H17O5NS | COC1CC(O)OC(C)C1NS(C)(=O)=O |
|
AD12746 | 4.19 | 353.41 | C21H17N6 | C1=Nc2c(ncnc2NCCc2c(-c3ccccc3)[nH]c3ccccc23)[N]1 |
|
AD12747 | 4.95 | 739.94 | C39H65O12N | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2OC(C)=O)C2(C)CC(C)=C(O2)C(C)C(OC(=O)C(C)C)C1(C)OC(=O)C(C)C |
|
AD12748 | 4.9 | 385.59 | C22H43O4N | CCCCCCCCCCCC(CC(=O)NCCO)OC(=O)CCCCC |
|
AD12749 | 3.34 | 530.66 | C30H42O8 | CC1(C)CC2(O)OC3CC4(C)C5CC=C6C(C=C(O)C(=O)C6(C)C)C5(C)C(=O)CC4(C)C3C(C)(O)C2(O)O1 |
|
AD12750 | 3.57 | 557.68 | C31H43O8N | CC1(C)C(=O)C(O)=CC2C1=CCC1C2(C)C(=O)CC2(C)C(C(C)(O)C(=O)CC3NC(=O)OC3(C)C)C(O)CC12C |