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        "molfile": "\n  Marvin  01132102322D          \n\n 24 19  0  0  0  0            999 V2000\n    9.1997   -0.7774    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.9315   -2.4497    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.9159    0.0088    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.0538    0.4155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.6365   -1.2111    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n    7.7581   -0.8048    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n    9.2011    0.0188    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0\n    4.2243   -2.0591    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0\n    9.9045   -1.1990    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    4.9329   -3.2915    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    5.6338    0.4344    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    7.0676    1.2382    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    5.6445   -2.0560    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.4869   -1.2094    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.7763    0.0058    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.9264   -0.8353    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.0565   -1.2299    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.3616   -0.8130    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.3532   -0.0121    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0\n    4.2089    0.4213    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0\n    6.9604   -2.2023    0.0000 Na  0  3  0  0  0  0  0  0  0  0  0  0\n    6.9604   -2.2023    0.0000 Na  0  3  0  0  0  0  0  0  0  0  0  0\n    6.9604   -2.2023    0.0000 Na  0  3  0  0  0  0  0  0  0  0  0  0\n    6.9604   -2.2023    0.0000 Na  0  3  0  0  0  0  0  0  0  0  0  0\n  5 18  1  0  0  0  0\n  6 14  1  0  0  0  0\n  7  1  1  0  0  0  0\n  8  2  1  0  0  0  0\n  9  1  2  0  0  0  0\n 10  2  2  0  0  0  0\n 11  3  2  0  0  0  0\n 12  4  2  0  0  0  0\n 13  5  1  0  0  0  0\n 14  1  1  0  0  0  0\n 15  6  1  0  0  0  0\n 16  5  1  0  0  0  0\n 17  6  1  0  0  0  0\n 18 17  1  0  0  0  0\n 19  4  1  0  0  0  0\n 20  3  1  0  0  0  0\n  2 13  1  0  0  0  0\n  3 16  1  0  0  0  0\n  4 15  1  0  0  0  0\nM  CHG  8   7  -1   8  -1  19  -1  20  -1  21   1  22   1  23   1  24   1\nM  STY  1   1 MUL\nM  SCN  1   1 HT \nM  SAL   1  4  21  22  23  24\nM  SPA   1  1  21\nM  SDI   1  4    6.5404   -2.6223    6.5404   -1.7823\nM  SDI   1  4    7.3804   -1.7823    7.3804   -2.6223\nM  SMT   1 4\nM  END",
        "smiles": "C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[Na+].[Na+].[Na+].[Na+]",
        "formula": "C10H12N2O8.4Na",
        "atropisomerism": "No",
        "charge": 0,
        "count": 1,
        "stereochemistry": "ACHIRAL",
        "defined_stereo": 0,
        "ez_centers": 0,
        "molecular_weight": "380.1704",
        "optical_activity": "NONE",
        "references": [
          "72304bc2-6fb0-40de-880c-7f6c81e8c959",
          "91a259ab-a3c0-4e4a-b01e-bd0a96665687"
        ],
        "stereo_centers": 0
      },
      "unii": "MP1J8420LU"
    }
  ]
}