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      "structure": {
        "id": "9d9124fd-a6d6-4986-a358-00a98a0f5bb0",
        "molfile": "\n  Marvin  01132108112D          \n\n 22 24  0  0  0  0            999 V2000\n   11.4601   -5.2540    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.6378   -5.8848    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   11.3418   -5.9900    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    7.7670   -2.9935    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    5.6378   -4.2288    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    6.3476   -2.9935    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    8.4767   -3.3877    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   10.6058   -4.6494    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    9.8961   -4.2288    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.3476   -5.4642    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   10.6058   -5.4642    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.0573   -5.8848    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.0573   -3.3877    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    9.8961   -5.8848    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.3476   -4.6494    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.4767   -5.8848    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    7.7670   -5.4642    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    9.1864   -5.4642    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.4767   -4.2288    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.0573   -4.2288    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    9.1864   -4.6494    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.7670   -4.6494    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n 11  8  1  0  0  0  0\n 18 21  2  0  0  0  0\n 10 15  1  0  0  0  0\n  1 11  1  0  0  0  0\n  2 10  1  0  0  0  0\n  3 11  1  0  0  0  0\n  4 13  1  0  0  0  0\n  5 15  1  0  0  0  0\n  6 13  2  0  0  0  0\n  7 19  2  0  0  0  0\n  8  9  1  0  0  0  0\n  9 21  1  0  0  0  0\n 10 12  2  0  0  0  0\n 11 14  1  0  0  0  0\n 12 17  1  0  0  0  0\n 13 20  1  0  0  0  0\n 14 18  1  0  0  0  0\n 15 20  2  0  0  0  0\n 16 17  1  0  0  0  0\n 17 22  2  0  0  0  0\n 18 16  1  0  0  0  0\n 19 22  1  0  0  0  0\n 20 22  1  0  0  0  0\n 21 19  1  0  0  0  0\nM  END",
        "smiles": "CC1(Cc2c(CO1)c(=O)c3c(cc(c(c3C(=O)O)O)O)o2)O",
        "formula": "C14H12O8",
        "atropisomerism": "No",
        "charge": 0,
        "count": 1,
        "stereochemistry": "RACEMIC",
        "defined_stereo": 0,
        "ez_centers": 0,
        "molecular_weight": "308.2408",
        "optical_activity": "( + / - )",
        "references": [
          "408e04ab-031d-48d4-84a4-d20401771927",
          "664d11fe-b4bd-4f90-9213-6202eabbfc2c"
        ],
        "stereo_centers": 1
      },
      "unii": "XII14C5FXV"
    }
  ]
}