aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD04721 | 3.16 | 1155.18 | C59H62O17N8 | CC=Cc1cc2ccc1Oc1cc3cc(c1O)Oc1ccc(cc1C=CC)C(O)C1NC(=O)C(NC(=O)C3NC(=O)C(CC(N)=O)NC(=O)C(NC(=O)C(CC(C)C)NC)C2O)c2ccc(O)c(c2)-c2c(O)cc(O)cc2C(C(=O)O)NC1=O |
|
AD04722 | 3.2 | 264.16 | C10H11O4F2P | COP1(=O)OCCC(c2cc(F)cc(F)c2)O1 |
|
AD04723 | 6.01 | 1045.1 | C57H60O17N2 | CC(=O)OC1C(=O)C2(C)C(O)CC3OCC3(OC(C)=O)C2C(OC(=O)c2ccccc2)C2(O)CC(OC(=O)C(OC(=O)CCc3ccc(NC(=O)O)cc3)C(NC(=O)c3ccccc3)c3ccccc3)C(C)=C1C2(C)C |
|
AD04724 | 5.69 | 358.57 | C24H38O2 | CC(=O)C1CCC2(C)C3=C(CCC12C)C1(C)CCC(O)C(C)(C)C1CC3 |
|
AD04725 | 1.2 | 137.14 | C7H7O2N | ON=Cc1ccc(O)cc1 |
|
AD04726 | -1.02 | 339.44 | C11H21O5N3S2 | COS(=O)(=O)NC(=O)C(CCSC)NC(=O)C1CCCN1 |
|
AD04727 | 0.77 | 420.44 | C19H20O7N2S | COC(=O)c1ccc(S(=O)(=O)Oc2ccc(CC(NC(C)=O)C(N)=O)cc2)cc1 |
|
AD04728 | -0.55 | 313.26 | C13H15O8N | O=[N+]([O-])c1ccc(C2OCC3OC(O)C(O)C(O)C3O2)cc1 |
|
AD04729 | -1.83 | 117.08 | C4H5O4 | O=C([O-])C=C(O)CO |
|
AD04730 | 3.4 | 315.39 | C17H17O3NS | CC(=O)C=Cc1cccc(NS(=O)(=O)c2ccc(C)cc2)c1 |