aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD22811 | 1.52 | 482.63 | C26H38O3N6 | NC1CC(N)C(O)C(NCCCCCCCCNC(=O)c2cc3c(cn2)[nH]c2ccccc23)C1O |
|
AD22812 | 3.1 | 298.28 | C4H12O5P2S3 | COP(=O)(S)OCCSP(=O)(S)OC |
|
AD22813 | -0.77 | 125.15 | C2H7O3NS | CCOS(N)(=O)=O |
|
AD22814 | 1.28 | 182.25 | C8H10ON2S | O=C(NCC1CC1)c1cscn1 |
|
AD22815 | 2.81 | 318.46 | C20H30O3 | C=C1CC23CC1CCC2C(=C)C1CC(O)C(C)(C)C1(O)C(O)C3 |
|
AD22816 | 2.89 | 196.21 | C12H8ON2 | c1ccc2cc(-c3ncon3)ccc2c1 |
|
AD22817 | 3.21 | 914.96 | C47H54O15N4 | CN(C(=O)OCc1ccccc1)C1C(O)OC2CC(NC(=O)OCc3ccccc3)C(OC3C(NC(=O)OCc4ccccc4)CC(NC(=O)OCc4ccccc4)C(O)C3O)OC2C1O |
|
AD22818 | 2.08 | 1280.59 | C63H113O23N3 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)CC(=O)N(C)C3CC(C)OC(OC4C(C)C(O)C(C)C(=O)OC(CC)C(C)(O)C(O)C(C)C(=NOCOCCOC)C(C)CC4(C)O)C3O)C2O)C(C)(OC)CC(C)C(=O)C(C)C(O)C1(C)O |
|
AD22819 | -0.54 | 203.29 | C9H21O2N3 | CN(CCCCN)CCC(N)C(=O)O |
|
AD22820 | 4.41 | 773.06 | C41H76O11N2 | CCCCCCCC(=O)NCCCOC1C(C)C(=O)C(C)CC(C)(OC)C(OC2OC(C)CC(N(C)C)C2O)C(C)C(O)C(C)C(=O)OC(CC)C1(C)O |