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          "molfile": "\n  Marvin  01132108272D          \n\n 28 29  0  0  0  0            999 V2000\n    1.7941   -1.5487    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    1.7941   -0.8632    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    2.5699   -0.4626    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.2271   -0.9139    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.9944   -0.4936    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.9944    0.2821    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.2948    0.7250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    2.5586    0.3413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    1.8675    0.7814    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n    1.1369    0.3837    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    1.1369   -0.3893    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    0.4316    0.8153    0.0000 C   0  0  0  0  0  0  0  0  0  3  0  0\n   -0.2538    0.3639    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n   -0.9901    0.7335    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n   -1.6813    0.2736    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -2.3977    0.6911    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -3.1059    0.2736    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -3.1059   -0.5444    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -2.3977   -0.9535    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -1.6813   -0.5444    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -0.9591   -0.9535    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   -0.2538   -0.4626    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -3.8280   -0.9535    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0\n   -3.8280   -1.7800    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0\n   -4.5445   -0.5444    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    0.4316    1.6418    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -0.3103    2.0339    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    1.1086    2.0649    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n  2  1  1  0  0  0  0\n  3  2  1  0  0  0  0\n  3  4  1  0  0  0  0\n  8  3  2  0  0  0  0\n  4  5  2  0  0  0  0\n  6  5  1  0  0  0  0\n  7  6  2  0  0  0  0\n  8  7  1  0  0  0  0\n  9  8  1  0  0  0  0\n 10  9  1  0  0  0  0\n 10 11  2  0  0  0  0\n 12 10  1  0  0  0  0\n 13 12  1  0  0  0  0\n 12 26  1  0  0  0  0\n 14 13  2  0  0  0  0\n 15 14  1  0  0  0  0\n 15 16  1  0  0  0  0\n 15 20  2  0  0  0  0\n 16 17  2  0  0  0  0\n 17 18  1  0  0  0  0\n 19 18  2  0  0  0  0\n 18 23  1  0  0  0  0\n 20 19  1  0  0  0  0\n 20 21  1  0  0  0  0\n 21 22  1  0  0  0  0\n 23 24  1  0  0  0  0\n 23 25  2  0  0  0  0\n 26 27  1  0  0  0  0\n 26 28  2  0  0  0  0\nM  CHG  2  23   1  24  -1\nM  END",
          "smiles": "CC(=O)C(C(=O)Nc1ccccc1OC)/N=N/c2ccc(cc2OC)[N+](=O)[O-]",
          "formula": "C18H18N4O6",
          "atropisomerism": "No",
          "charge": 0,
          "count": 1,
          "stereochemistry": "RACEMIC",
          "count_amount": {
            "type": "MOL RATIO",
            "average": 1,
            "units": "MOL RATIO",
            "uuid": "b111606c-8467-42f6-9a1c-9956582c5794"
          },
          "defined_stereo": 0,
          "ez_centers": 1,
          "molecular_weight": "386.3594",
          "optical_activity": "( + / - )",
          "stereo_centers": 1
        }
      ],
      "definition_level": "COMPLETE",
      "uuid": "fc38c917-769d-44f5-9dc6-44efbaf943da",
      "version": "8",
      "structure": {
        "id": "22c8d555-6d03-4f5a-a57a-b4e85ba648ed",
        "molfile": "\n  Marvin  01132101572D          \n\n 28 29  0  0  0  0            999 V2000\n   -1.6813    0.2736    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -1.6813   -0.5444    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -2.3977    0.6911    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -0.9901    0.7335    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n   -2.3977   -0.9535    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -0.9591   -0.9535    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   -3.1059    0.2736    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -0.2538    0.3639    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n   -3.1059   -0.5444    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -0.2538   -0.4626    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    0.4316    0.8153    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -3.8280   -0.9535    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0\n    1.1369    0.3837    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    0.4316    1.6418    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -3.8280   -1.7800    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   -4.5445   -0.5444    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0\n    1.8675    0.7814    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n    1.1369   -0.3893    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   -0.3103    2.0339    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    1.1086    2.0649    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    2.5586    0.3413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    2.5699   -0.4626    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.2948    0.7250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.2271   -0.9139    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    1.7941   -0.8632    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    3.9944    0.2821    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.9944   -0.4936    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    1.7941   -1.5487    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n  1  2  2  0  0  0  0\n  1  3  1  0  0  0  0\n  1  4  1  0  0  0  0\n  2  5  1  0  0  0  0\n  2  6  1  0  0  0  0\n  3  7  2  0  0  0  0\n  4  8  2  0  0  0  0\n  5  9  2  0  0  0  0\n  6 10  1  0  0  0  0\n  8 11  1  0  0  0  0\n  9 12  1  0  0  0  0\n 11 13  1  0  0  0  0\n 11 14  1  0  0  0  0\n 12 15  2  0  0  0  0\n 12 16  1  0  0  0  0\n 13 17  1  0  0  0  0\n 13 18  2  0  0  0  0\n 14 19  1  0  0  0  0\n 14 20  2  0  0  0  0\n 17 21  1  0  0  0  0\n 21 22  2  0  0  0  0\n 21 23  1  0  0  0  0\n 22 24  1  0  0  0  0\n 22 25  1  0  0  0  0\n 23 26  2  0  0  0  0\n 24 27  2  0  0  0  0\n 25 28  1  0  0  0  0\n  7  9  1  0  0  0  0\n 26 27  1  0  0  0  0\nM  CHG  2  12   1  16  -1\nM  END",
        "smiles": "CC(=O)C(C(=O)Nc1ccccc1OC)/N=N/c2ccc(cc2OC)[N+](=O)[O-]",
        "formula": "C18H18N4O6",
        "atropisomerism": "No",
        "charge": 0,
        "count": 1,
        "stereochemistry": "RACEMIC",
        "defined_stereo": 0,
        "ez_centers": 1,
        "molecular_weight": "386.3594",
        "optical_activity": "( + / - )",
        "references": [
          "ebc902b3-087e-4334-97b5-99212272e308",
          "8692d792-5586-44bd-ae30-8f1506176426"
        ],
        "stereo_centers": 1
      },
      "unii": "85338B499O"
    }
  ]
}