aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD06951 | 1.93 | 752.86 | C36H56O13N4 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(NC(=O)COc3cc(N=[N+]=[N-])ccc3CO)C2O)C(C)(O)CC(C)C(=O)C(C)C(O)C1(C)O |
|
AD06952 | 1.2 | 181.19 | C9H11O3N | O=C(O)NCCc1ccc(O)cc1 |
|
AD06953 | 4.4 | 300.4 | C18H24O2N2 | CCCCCCCCCCC#Cc1cc2c[nH]c(=O)nc2o1 |
|
AD06954 | 0.29 | 716.6 | C36H28O16 | O=C(OC(Cc1ccc(O)c(O)c1)C(=O)[O-])C1=Cc2cc(O)c(O)cc2C(c2ccc(O)c(O)c2)C1C(=O)OC(Cc1ccc(O)c(O)c1)C(=O)[O-] |
|
AD06955 | 3.7 | 284.37 | C14H8ON2S2 | N#Cc1c(-c2cccs2)cc(-c2cccs2)[nH]c1=O |
|
AD06956 | 1.33 | 414.37 | C21H18O9 | CC1OC(c2c(O)cc3oc(-c4ccc(O)cc4)cc(=O)c3c2O)C(O)C(=O)C1O |
|
AD06957 | -0.05 | 226.23 | C11H14O5 | C=C1CC(O)C2C(C(=O)OC)=COC(O)C12 |
|
AD06958 | 4.58 | 240.33 | C15H12OS | COc1ccc(-c2cc3ccccc3s2)cc1 |
|
AD06959 | 7.46 | 482.75 | C32H50O3 | C=C1OC23C=CC4C1(CCC1(C)C(C(C)CC=CC(C)(C)OC)CCC41C)C2CCC(O)C3(C)C |
|
AD06960 | 2.34 | 326.41 | C16H16ON5S | c1ccc(CSc2ncnc3c2N=C(N2CCOCC2)[N]3)cc1 |