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          "atropisomerism": "No",
          "charge": -1,
          "count": 1,
          "stereochemistry": "ACHIRAL",
          "count_amount": {
            "type": "MOL RATIO",
            "average": 1,
            "units": "MOL RATIO",
            "uuid": "bbfee06e-91c5-4165-9ee8-92b17cd0056b"
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          "molecular_weight": "125.1249",
          "optical_activity": "NONE",
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          "id": "49a2d517-94d6-47f3-9802-57ac3fd8fab8",
          "molfile": "\n  Marvin  01132103512D          \n\n 24 24  0  0  0  0            999 V2000\n   13.9029  -13.0578    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   13.8858  -12.2331    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   13.1631  -11.8353    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   13.1460  -11.0106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   12.4231  -10.6129    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   12.4060   -9.7880    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   11.6833   -9.3904    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   11.6662   -8.5655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   10.9434   -8.1679    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   10.9263   -7.3431    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   10.2035   -6.9454    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   10.1864   -6.1206    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    9.4636   -5.7229    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    9.4465   -4.8981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.7237   -4.5004    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.7066   -3.6756    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.9838   -3.2779    0.0000 N   0  3  0  0  0  0  0  0  0  3  0  0\n    8.5010   -2.6351    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.2028   -1.8659    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.4406   -2.6570    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.6312   -2.8171    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.3651   -3.5980    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    6.9084   -4.2189    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.7177   -4.0588    0.0000 C   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  4  3  1  0  0  0  0\n  5  4  1  0  0  0  0\n  6  5  1  0  0  0  0\n  7  6  1  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 11 10  1  0  0  0  0\n 12 11  1  0  0  0  0\n 13 12  1  0  0  0  0\n 14 13  1  0  0  0  0\n 15 14  1  0  0  0  0\n 15 16  1  0  0  0  0\n 17 16  1  0  0  0  0\n 17 18  1  0  0  0  0\n 20 17  1  0  0  0  0\n 17 24  1  0  0  0  0\n 18 19  1  0  0  0  0\n 21 20  1  0  0  0  0\n 21 22  1  0  0  0  0\n 23 22  1  0  0  0  0\n 24 23  1  0  0  0  0\nM  CHG  1  17   1\nM  END",
          "smiles": "CCCCCCCCCCCCCCCC[N+]1(CC)CCOCC1",
          "formula": "C22H46NO",
          "atropisomerism": "No",
          "charge": 1,
          "count": 1,
          "stereochemistry": "RACEMIC",
          "count_amount": {
            "type": "MOL RATIO",
            "average": 1,
            "units": "MOL RATIO",
            "uuid": "33bc7c4c-468b-40d7-a551-183b680637bc"
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          "ez_centers": 0,
          "molecular_weight": "340.6076",
          "optical_activity": "NONE",
          "stereo_centers": 0
        }
      ],
      "definition_level": "COMPLETE",
      "uuid": "28836db6-7ba8-413f-8f11-d37a7e63c19a",
      "version": "5",
      "structure": {
        "id": "57fbd16b-2bff-420c-8530-4060744fa8d8",
        "molfile": "\n  Marvin  01132104342D          \n\n 31 30  0  0  0  0            999 V2000\n    7.9838   -3.2779    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0\n    8.7066   -3.6756    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.7237   -4.5004    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    9.4465   -4.8981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    9.4636   -5.7229    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   10.1864   -6.1206    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   10.2035   -6.9454    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   10.9263   -7.3431    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   10.9434   -8.1679    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   11.6662   -8.5655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   11.6833   -9.3904    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   12.4060   -9.7880    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   12.4231  -10.6129    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   13.1460  -11.0106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   13.1631  -11.8353    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   13.8858  -12.2331    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   13.9029  -13.0578    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.5010   -2.6351    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.2028   -1.8659    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.4406   -2.6570    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.6312   -2.8171    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.3651   -3.5980    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    6.9084   -4.2189    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.7177   -4.0588    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   12.6372   -4.9646    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   13.4622   -4.9646    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   13.8747   -5.6790    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   14.6997   -5.6790    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0\n   15.5248   -5.6790    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0\n   14.6997   -6.5040    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   14.6997   -4.8540    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n  1  2  1  0  0  0  0\n  3  2  1  0  0  0  0\n  3  4  1  0  0  0  0\n  4  5  1  0  0  0  0\n  5  6  1  0  0  0  0\n  6  7  1  0  0  0  0\n  7  8  1  0  0  0  0\n  8  9  1  0  0  0  0\n  9 10  1  0  0  0  0\n 10 11  1  0  0  0  0\n 11 12  1  0  0  0  0\n 12 13  1  0  0  0  0\n 13 14  1  0  0  0  0\n 14 15  1  0  0  0  0\n 15 16  1  0  0  0  0\n 16 17  1  0  0  0  0\n  1 18  1  0  0  0  0\n 18 19  1  0  0  0  0\n 20  1  1  0  0  0  0\n 21 20  1  0  0  0  0\n 21 22  1  0  0  0  0\n 23 22  1  0  0  0  0\n 24 23  1  0  0  0  0\n  1 24  1  0  0  0  0\n 25 26  1  0  0  0  0\n 26 27  1  0  0  0  0\n 27 28  1  0  0  0  0\n 28 29  1  0  0  0  0\n 28 30  2  0  0  0  0\n 28 31  2  0  0  0  0\nM  CHG  2   1   1  29  -1\nM  END",
        "smiles": "CCCCCCCCCCCCCCCC[N+]1(CC)CCOCC1.CCOS(=O)(=O)[O-]",
        "formula": "C22H46NO.C2H5O4S",
        "atropisomerism": "No",
        "charge": 0,
        "count": 1,
        "stereochemistry": "ACHIRAL",
        "defined_stereo": 0,
        "ez_centers": 0,
        "molecular_weight": "465.7325",
        "optical_activity": "NONE",
        "references": [
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          "e1f9c1e5-49a3-4726-b0ef-efaa149d9080"
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      "unii": "FU19SYM476"
    }
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}