aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD10411 | 2.27 | 614.78 | C31H54O10N2 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(OC)CC(C)C(=O)C(C)C2NC(=O)OC12C |
|
AD10412 | 2.25 | 407.85 | C20H22O5N3Cl | COC(=O)c1cn(C2CC2)c2cc(Cl)c(NCCNCCC(=O)O)cc2c1=O |
|
AD10413 | 1.2 | 347.37 | C17H21O5N3 | CCn1cc(C(=O)O)c(=O)c2ccc(NCCNCCC(=O)O)cc21 |
|
AD10414 | -1.81 | 2369.93 | C71H96O45N14P8S8 | COP(O)(=S)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(O)(=S)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(O)(=S)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(O)(=S)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(O)(=S)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(O)(=S)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(O)(=S)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(O)(O)=S |
|
AD10415 | 9.26 | 591.96 | C37H69O4N | CCCCCCCCCCCCCCCC=CC(O)C(=O)NC(CO)C(O)C=CCCC=C(C)CCCCCCCC |
|
AD10416 | 8.48 | 563.91 | C35H65O4N | CCCCCCCCCCCCCCCC=CC(O)C(=O)NC(CO)C(O)C=CCCC=C(C)CCCCCC |
|
AD10417 | 1.39 | 322.34 | C14H14N10 | C1=Nc2c(ncnc2NCCCCNc2ncnc3c2N=C[N]3)[N]1 |
|
AD10418 | 2.15 | 366.14 | C12H9ON5I | Nc1nc2c(c(OCc3ccc(I)cc3)n1)N=C[N]2 |
|
AD10419 | 2.09 | 308.32 | C15H14ON7 | COc1ccccc1C=CC=NNc1nc(N)c2c(n1)[N]C=N2 |
|
AD10420 | 0.4 | 90.08 | C3H6O3 | COC(=O)OC |