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      "structure": {
        "id": "c1ad50ce-d5aa-4488-8815-5f780d6bdbec",
        "molfile": "\n  Marvin  01132110012D          \n\n 21 23  0  0  1  0            999 V2000\n    6.2641   -6.0959    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.9786   -6.5080    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.6989   -6.0959    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0\n    8.4032   -6.5080    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    7.6989   -5.2716    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0\n    6.9838   -4.8439    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    6.2641   -5.2664    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.5393   -4.8542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.8247   -5.2716    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.8247   -6.0959    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.5393   -6.5080    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.5393   -7.3322    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    4.1096   -4.8439    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    8.4134   -4.8594    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    9.1281   -5.2716    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    9.8477   -4.8696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    9.8477   -4.0403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    9.1281   -3.6230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.4134   -4.0352    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   10.5577   -3.6230    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    6.9786   -7.3374    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  1  0  0  0\n  3  5  1  0  0  0  0\n  5  6  1  0  0  0  0\n  6  7  1  0  0  0  0\n  7  1  1  0  0  0  0\n  8  7  2  0  0  0  0\n  8  9  1  0  0  0  0\n  9 10  2  0  0  0  0\n 10 11  1  0  0  0  0\n 11  1  2  0  0  0  0\n 12 11  1  0  0  0  0\n 13  9  1  0  0  0  0\n  5 14  1  6  0  0  0\n 15 14  2  0  0  0  0\n 16 15  1  0  0  0  0\n 16 17  2  0  0  0  0\n 17 18  1  0  0  0  0\n 18 19  2  0  0  0  0\n 19 14  1  0  0  0  0\n 20 17  1  0  0  0  0\n 21  2  2  0  0  0  0\nM  END",
        "smiles": "c1cc(ccc1[C@@H]2[C@H](C(=O)c3c(cc(cc3O2)O)O)O)O",
        "formula": "C15H12O6",
        "atropisomerism": "No",
        "charge": 0,
        "count": 1,
        "stereochemistry": "ABSOLUTE",
        "defined_stereo": 2,
        "ez_centers": 0,
        "molecular_weight": "288.2528",
        "optical_activity": "UNSPECIFIED",
        "references": [
          "28a27b83-9fb6-47ee-8e17-bcc08bc7200a",
          "b3b6a654-b3b1-41c9-bc6e-f1b538fa66c3"
        ],
        "stereo_centers": 2
      },
      "unii": "7YA4640575"
    }
  ]
}