aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD05401 | 3.38 | 425.4 | C23H15O4N5 | N#CCCNN1C(=O)c2c(c3c4cccc(O)c4[nH]c3c3[nH]c4c(O)cccc4c23)C1=O |
|
AD05402 | 1.8 | 799.02 | C38H70O10N8 | CC(C)CCCCCCCCCCC(=O)OC(C(C)C)C(NC(=O)C(NC(=O)NC(C(=O)O)C(C)C)C1CCNC(=N)N1)C(=O)NCCCNC(CO)C(=O)O |
|
AD05403 | 2.01 | 394.2 | C14H13ON5I | OCC(Cc1ccccc1)Nc1nc(I)nc2c1N=C[N]2 |
|
AD05404 | 1.07 | 350.28 | C15H12O4N4F2 | CCn1cc(C(=O)O)c(=O)c2cc(F)c(-n3cc(CO)nn3)c(F)c21 |
|
AD05405 | 5.09 | 606.76 | C36H46O8 | CCC1OC(=O)CC(O)C(C)C(O)C(CCOc2ccc(C(=O)c3ccccc3)cc2)CC(C)C(=O)C=CC(C)=CC1CO |
|
AD05406 | 4.58 | 458.64 | C28H42O5 | COC1OC2(C)C(C=C(C)C)C(O)OC3CC4C5CC=C6CC(O)CCC6(C)C5CCC14C32 |
|
AD05407 | 5.32 | 628.85 | C37H56O8 | CC=C(C)C(=O)OC1C(O)C2(COC(C)=O)C(O)CC3(C)C(=CCC4C5(C)CCC(O)C(C)(C=O)C5CCC43C)C2CC1(C)C |
|
AD05408 | -0.05 | 101.15 | C5H11ON | CN1CCOCC1 |
|
AD05409 | 7.03 | 538.64 | C34H34O6 | O=C(O)Cc1cccc(-c2cc(CCCCCCc3ccc(O)c(-c4cccc(CC(=O)O)c4)c3)ccc2O)c1 |
|
AD05410 | -0.22 | 144.17 | C7H12O3 | CC1C2COC1C(O)CO2 |