| Formula | C28H32N2O9 |
| MW | 540.57 |
| bulk_in | / |
| comment | nan |
| inchikey | LFQUBXFJMDXKJW-UHFFFAOYSA-N |
| literature | UNKNOWN |
| location | FKKT-HLAD_1 |
| mass | 13,0 |
| nmr_code | NO_NMR_DATA |
| rack_code | NU00246861 |
| rack_number | 1 |
| rack_position | 1B8 |
| reasearcher | A._IVANCIC |
| research_group | SVETE |
| sample_state | TRUE_SAMPLE |
| smiles | COC(=O)C1=CN(C(=O)OC(C)(C)C)C(CC2=CC=C(OC)C=C2)(C(C[N+]([O-])=O)C2=CC=C(OC)C=C2)C1=O |
| vial_code | NUJD034574 |
| vial_size | 1_mL |
| mw | 540.5617 |
| alogp | 4.3943 |
| hba | 7 |
| hbd | 0 |
| rb | 12 |
| heavyatomcount | 39 |
| chiralcentercount | 0 |
| chiralcentercountallpossible | 2 |
| ringcount | 3 |
| psa | 134.51 |
| estate | 103.169 |
| mr | 140.9269 |
| polar | 60.719 |
| canvasuid | 20 |