aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD00831 | 6.95 | 470.74 | C31H50O3 | COC(C=C(C)C)CC(C)C1CCC2(C)C3C=CC45OCC3(CCC12C)C4CCC(O)C5(C)C |
|
AD00832 | 3.48 | 600.75 | C33H48O8N2 | CCC(=O)OC1CC(=O)OC(C)CCN(CCCc2ccnc3ccccc23)CC(O)C(C)CC(CC=O)C(O)C1OC |
|
AD00833 | 3.9 | 186.34 | C12H26O | CCCCCCCCCCCCO |
|
AD00834 | 5.33 | 476.74 | C30H52O4 | CC(C)C=CCC(C)(O)C1CCC2(C)C1C(O)CC1C3(C)CC(O)C(O)C(C)(C)C3CCC12C |
|
AD00835 | 2.0 | 664.95 | C33H64O9N2S | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)C(NCCCSC)C(C)C(O)C1(C)O |
|
AD00836 | -0.24 | 294.29 | C11H10O4N4S | C=NNS(=O)(=O)c1ccc(C=C2NC(=O)NC2=O)cc1 |
|
AD00837 | 2.9 | 308.24 | C13H9ON5F3 | FC(F)(F)Oc1ccccc1CNc1ncnc2c1N=C[N]2 |
|
AD00838 | 1.78 | 237.26 | C14H11ON3 | Nn1c(-c2ccccc2)nc2ccccc2c1=O |
|
AD00839 | -0.66 | 997.2 | C47H80O15N8 | O=C(CCCCO)NCCCNC(=O)CCOCC(COCCC(=O)NCCCNC(=O)CCCCO)(COCCC(=O)NCCCNC(=O)CCCCO)NC(=O)CNC(=O)OCc1ccccc1 |
|
AD00840 | 3.46 | 486.7 | C28H46O3N4 | CCCC(NC(=O)C(Cc1ccccc1)NC(=O)C(N)C(C)CC)C(=O)NCCC1CCCCC1 |