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        "molfile": "\n  Marvin  01132101092D          \n\n 24 25  0  0  0  0            999 V2000\n    4.2481    0.7111    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.5336    0.2986    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    2.8192    0.7111    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    2.1047    0.2986    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    1.3902    0.7111    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    2.1047   -0.5264    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    2.8192   -0.9389    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    2.8192   -1.7639    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.5336   -0.5264    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.2481   -0.9389    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.2481   -1.7639    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.9626   -2.1764    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.9626   -3.0014    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    5.6771   -1.7639    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.3916   -2.1764    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.1060   -1.7639    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.8205   -2.1764    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.3916   -3.0014    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n    7.1060   -3.4139    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    7.1060   -4.2389    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.8205   -4.6514    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.6771   -0.9389    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.3916   -0.5264    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    4.9626   -0.5264    0.0000 C   0  0  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  2  0  0  0  0\n  4  5  1  0  0  0  0\n  4  6  1  0  0  0  0\n  6  7  2  0  0  0  0\n  7  8  1  0  0  0  0\n  7  9  1  0  0  0  0\n  9  2  2  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 12 14  2  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 15 18  2  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 14 22  1  0  0  0  0\n 22 23  2  0  0  0  0\n 22 24  1  0  0  0  0\n 24 10  1  0  0  0  0\nM  END",
        "smiles": "CC/C(=N\\OCC)/C1=C(CC(CC1=O)c2c(C)cc(C)cc2C)O",
        "formula": "C20H27NO3",
        "atropisomerism": "No",
        "charge": 0,
        "count": 1,
        "stereochemistry": "ACHIRAL",
        "defined_stereo": 0,
        "ez_centers": 1,
        "molecular_weight": "329.434",
        "optical_activity": "( + / - )",
        "references": [
          "f882a930-8856-438f-a002-be0bf2a44c02",
          "673afab3-c16b-49d6-a25e-2b5a9e9cab21"
        ],
        "stereo_centers": 1
      },
      "unii": "39J71H3DDD"
    }
  ]
}