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        "molfile": "\n  Marvin  01132111412D          \n\n 22 20  0  0  0  0            999 V2000\n    2.8520   -1.6673    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    2.1396   -2.0932    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n    0.7201   -2.1086    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    1.4273   -1.6905    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    0.0000   -1.7060    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0\n    2.8442   -0.8466    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    0.7278   -2.9294    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    3.5694   -2.0777    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    2.1474   -2.9139    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.2818   -1.6518    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   11.4155   -1.5589    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   10.7083   -1.9848    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    9.9831   -1.5744    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.9967   -2.0544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.7013   -1.6286    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.4214   -2.0390    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.1311   -1.6131    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.8512   -2.0157    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.5584   -1.5976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    9.2785   -2.0002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   12.1278   -1.9589    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    1.1769    0.0000    0.0000 Na  0  3  0  0  0  0  0  0  0  0  0  0\n  2  1  1  0  0  0  0\n  3  4  1  0  0  0  0\n  4  2  1  0  0  0  0\n  5  3  1  0  0  0  0\n  6  1  2  0  0  0  0\n  7  3  2  0  0  0  0\n  8  1  1  0  0  0  0\n  9  2  1  0  0  0  0\n 10  8  1  0  0  0  0\n 11 12  1  0  0  0  0\n 12 13  1  0  0  0  0\n 13 20  1  0  0  0  0\n 14 10  1  0  0  0  0\n 15 14  1  0  0  0  0\n 16 15  1  0  0  0  0\n 17 16  1  0  0  0  0\n 18 17  1  0  0  0  0\n 19 18  1  0  0  0  0\n 20 19  1  0  0  0  0\n 21 11  1  0  0  0  0\nM  CHG  2   5  -1  22   1\nM  END",
        "smiles": "CCCCCCCCCCCCCC(=O)N(C)CC(=O)[O-].[Na+]",
        "formula": "C17H32NO3.Na",
        "atropisomerism": "No",
        "charge": 0,
        "count": 1,
        "stereochemistry": "ACHIRAL",
        "defined_stereo": 0,
        "ez_centers": 0,
        "molecular_weight": "321.4313",
        "optical_activity": "NONE",
        "references": [
          "73f500d0-8b36-47bb-9403-20bf6e3b78ab",
          "621a949c-e629-4dce-810e-4d85f796bf63"
        ],
        "stereo_centers": 0
      },
      "unii": "J07237209D"
    }
  ]
}