aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD23491 | 1.7 | 949.23 | C49H88O17 | CCC(O)C(C)C(O)C(C)C(O)C(C)C1OC(=O)C=CC(C)C(O)CC(O)CCCC(O)CCC(C)C(O)C(=O)C2(O)CC(O)CC(CC(O)CC(O)CC(O)CCCC(O)C=CC1C)O2 |
|
AD23492 | 5.4 | 347.81 | C21H14ON3Cl | Oc1ccc(Nc2nc(-c3ccc(Cl)cc3)nc3ccccc23)cc1 |
|
AD23493 | 2.97 | 248.32 | C15H20O3 | C=C(C(=O)O)C1CCC(C)C2CC(=O)C(C)=C2C1 |
|
AD23494 | 2.41 | 272.26 | C15H12O5 | O=C(C=Cc1ccc(O)c(O)c1)c1ccc(O)cc1O |
|
AD23495 | 5.77 | 539.76 | C32H49O4N3 | CC(C)C(C)C1(C)CCC2(C)C3CCC4C5(COCC4(C)C(O)C(n4cncn4)C5)C3=CCC2(C)C1C(=O)O |
|
AD23496 | 4.81 | 506.58 | C27H26O6N2S | O=C(O)c1cc(NC(=S)NCCCCCCO)ccc1-c1c2ccc(=O)cc-2oc2cc(O)ccc12 |
|
AD23497 | 1.36 | 291.33 | C13H13O3N3S | COc1cccc2cc(C(C)=NNC(N)=S)c(=O)oc12 |
|
AD23498 | 1.66 | 275.33 | C13H13O2N3S | CC(=NNC(N)=S)c1cc2cc(C)ccc2oc1=O |
|
AD23499 | -1.8 | 727.98 | C32H61O6N11S | CCC(C)C(NC(=O)C(CCCNC(=N)N)NC(=O)C(CCCCN)NC(=O)C1CCCN1C(=O)CNCCCSC)C(=O)NC(C)C(N)=O |
|
AD23500 | 8.79 | 531.83 | C36H53O2N | CC1(C)CCC2(C(=O)Nc3ccccc3)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1 |