aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD13591 | 1.77 | 282.34 | C15H22O5 | CCCCOC1C=C(C)C2C(O)OC=C(C(=O)OC)C12 |
|
AD13592 | 4.34 | 655.37 | C17H18O4NF17S | O=C(CCSCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)NC(CO)(CO)CO |
|
AD13593 | 3.56 | 633.65 | C32H29O5N10 | NCCOc1cc(NC(=O)c2cc(OCC3=C[N]N=N3)cc(C(=O)Nc3cc(OCCN)c4ccccc4n3)n2)nc2ccccc12 |
|
AD13594 | 2.93 | 191.3 | C11H13NS | CNCc1c(C)sc2ccccc12 |
|
AD13595 | 1.21 | 113.18 | C5H7NS | NCc1cccs1 |
|
AD13596 | 3.87 | 706.74 | C38H42O13 | O=CC1(C=CO)CCC(COC(=O)C2=Cc3ccc(O)c(O)c3C(c3ccc(O)cc3)C2C(=O)OCC2CCC(C=O)(C=CO)C(O)C2)CC1O |
|
AD13597 | 6.43 | 515.82 | C30H61O5N | CCCCCCCCCCCCCCCCCCCCCCCC(=O)NC(CO)C(O)C(O)COC |
|
AD13598 | -2.06 | 462.49 | C19H28O5N9 | CCC(NC(=O)C(C)O)C(=O)NC(CCC(=O)NCCNc1ncnc2c1N=C[N]2)C(N)=O |
|
AD13599 | 1.87 | 240.21 | C14H8O4 | O=C1c2ccccc2C(=O)c2c(O)cc(O)cc21 |
|
AD13600 | -2.35 | 460.48 | C19H26O5N9 | NC(=O)C(CCC(=O)NCCNc1ncnc2c1N=C[N]2)NC(=O)C1CCCN1C(=O)CO |