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        "id": "52d0f366-9675-4096-891b-61b80ed20f7d",
        "molfile": "\n  Marvin  01132104192D          \n\n 36 33  0  0  0  0            999 V2000\n   12.9820   -4.9812    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   13.6984   -4.5549    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n   14.4147   -4.9471    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   15.1139   -4.5378    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   15.8473   -4.9301    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n   16.5466   -4.5037    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   17.2629   -4.9130    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   17.9622   -4.4867    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0\n   17.2799   -5.7317    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   15.8473   -5.7487    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   15.1481   -6.1751    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   14.2953   -5.7317    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0\n   15.1310   -6.9426    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   13.6813   -3.7362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   14.3806   -3.3099    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   15.0969   -3.7021    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   12.9991   -5.7999    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   12.2828   -4.5549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   11.5665   -4.9812    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   10.8672   -4.5549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   10.1509   -4.9812    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    9.4346   -4.5549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.7353   -4.9812    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.0190   -4.5549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.3027   -4.9812    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.5864   -4.5549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.8872   -4.9812    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.1708   -4.5549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.4716   -4.9812    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.7552   -4.5549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.0389   -4.9812    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    2.3397   -4.5549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    1.6234   -4.9812    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    0.9071   -4.5549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   16.9389   -3.1564    0.0000 Na  0  3  0  0  0  0  0  0  0  0  0  0\n   16.9389   -3.1564    0.0000 Na  0  3  0  0  0  0  0  0  0  0  0  0\n  1  2  1  0  0  0  0\n  2  3  1  0  0  0  0\n  3  4  1  0  0  0  0\n  5  4  1  0  0  0  0\n  5  6  1  0  0  0  0\n  7  6  1  0  0  0  0\n  7  8  1  0  0  0  0\n  7  9  2  0  0  0  0\n  5 10  1  0  0  0  0\n 11 10  1  0  0  0  0\n 11 12  1  0  0  0  0\n 11 13  2  0  0  0  0\n  2 14  1  0  0  0  0\n 14 15  1  0  0  0  0\n 16 15  1  0  0  0  0\n  1 17  2  0  0  0  0\n  1 18  1  0  0  0  0\n 18 19  1  0  0  0  0\n 19 20  1  0  0  0  0\n 20 21  1  0  0  0  0\n 22 21  1  0  0  0  0\n 22 23  1  0  0  0  0\n 23 24  1  0  0  0  0\n 24 25  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 29 30  1  0  0  0  0\n 30 31  1  0  0  0  0\n 32 31  1  0  0  0  0\n 33 32  1  0  0  0  0\n 33 34  1  0  0  0  0\nM  CHG  4   8  -1  12  -1  35   1  36   1\nM  STY  1   1 MUL\nM  SCN  1   1 HT \nM  SAL   1  2  35  36\nM  SPA   1  1  35\nM  SDI   1  4   16.5189   -3.5764   16.5189   -2.7364\nM  SDI   1  4   17.3589   -2.7364   17.3589   -3.5764\nM  SMT   1 2\nM  END",
        "smiles": "CCCCCCCCCCCCCCCCCC(=O)N(CCN(CC(=O)[O-])CC(=O)[O-])CCO.[Na+].[Na+]",
        "formula": "C26H48N2O6.2Na",
        "atropisomerism": "No",
        "charge": 0,
        "count": 1,
        "stereochemistry": "ACHIRAL",
        "defined_stereo": 0,
        "ez_centers": 0,
        "molecular_weight": "530.6497",
        "optical_activity": "NONE",
        "references": [
          "b775aa26-b8b4-4257-a348-59881e347182",
          "4794ec14-cdc2-41d6-83f0-a53cf81dcbbb"
        ],
        "stereo_centers": 0
      },
      "unii": "DL6516PAT8"
    }
  ]
}