aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD01371 | 1.28 | 326.27 | C12H14O7N4 | O=C(O)NCCCCNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 |
|
AD01372 | 1.78 | 195.17 | C9H9O4N | CC(C(=O)O)c1ccc([N+](=O)[O-])cc1 |
|
AD01373 | 3.57 | 291.13 | C14H12O4Cl2 | C=CCOc1c(Cl)c(C)c(C(=O)O)c(OC)c1Cl |
|
AD01374 | -1.56 | 306.31 | C13H22O8 | CC1OC2(CC(O)C1O)OC1C(C)OC(O)C(O)C1(C)O2 |
|
AD01375 | 0.16 | 205.21 | C8H15O5N | COC1C(C)OC(O)CC1(C)[N+](=O)[O-] |
|
AD01376 | -1.15 | 442.37 | C19H22O12 | Cc1cc(O)cc(O)c1C(=O)OC1COC2(OC3COC(O)C(O)C3O2)C2OCOC12 |
|
AD01377 | -2.05 | 188.98 | CH3O7P2 | COP(=O)([O-])OP(=O)([O-])[O-] |
|
AD01378 | 3.6 | 374.52 | C23H34O4 | CC12CCC(O)CC1CCC1C2CCC2(C)C(C3=CC(=O)OC3)CCC12O |
|
AD01379 | 1.29 | 648.88 | C33H64O10N2 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)C(NCCCOC)C(C)C(O)C1(C)O |
|
AD01380 | 1.97 | 250.28 | C14H12N5 | C1=Nc2c(ncnc2NC2Cc3ccccc3C2)[N]1 |