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          "smiles": "CC1(C)[C@H](C(=O)O)N2C(=O)[C@H]([C@H]2S1)NC(=O)COc3ccccc3",
          "formula": "C16H18N2O5S",
          "atropisomerism": "No",
          "charge": 0,
          "count": 1,
          "stereochemistry": "ABSOLUTE",
          "count_amount": {
            "type": "MOL RATIO",
            "average": 1,
            "units": "MOL RATIO",
            "uuid": "7480f2e3-a7c7-446b-87c7-7f96200f613c"
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          "molecular_weight": "350.3912",
          "optical_activity": "UNSPECIFIED",
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      "definition_level": "COMPLETE",
      "uuid": "8e6d3388-1d7e-48cf-bc33-e8ec0cc51b49",
      "version": "40",
      "structure": {
        "id": "6c7eaa3e-5b35-4bff-9221-13725a605008",
        "molfile": "\n  Marvin  01132105382D          \n\n 25 27  0  0  1  0            999 V2000\n   12.8125   -8.3667    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n   12.8042   -7.5417    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0\n   11.9792   -8.3667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   11.9792   -7.5417    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0\n   13.5917   -8.6167    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0\n   13.5875   -7.2792    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0\n   14.0792   -7.9500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   11.1542   -7.5417    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n   13.5917   -9.4417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   10.4375   -7.1292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   11.3917   -8.9542    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   12.8750   -9.8542    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   10.4375   -6.3042    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    9.0042   -7.1250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    9.7167   -7.5375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   14.3042   -9.8542    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   14.7917   -8.3625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   14.7917   -7.5292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.2917   -7.5375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.5792   -7.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.3000   -8.3542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.5917   -8.7667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.8667   -7.5375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.8750   -8.3625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   12.8000   -6.7167    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0\n  2  1  1  0  0  0  0\n  3  1  1  0  0  0  0\n  4  3  1  0  0  0  0\n  5  1  1  0  0  0  0\n  6  2  1  0  0  0  0\n  7  5  1  0  0  0  0\n  4  8  1  1  0  0  0\n  5  9  1  6  0  0  0\n 10  8  1  0  0  0  0\n 11  3  2  0  0  0  0\n 12  9  2  0  0  0  0\n 13 10  2  0  0  0  0\n 14 15  1  0  0  0  0\n 15 10  1  0  0  0  0\n 16  9  1  0  0  0  0\n 17  7  1  0  0  0  0\n 18  7  1  0  0  0  0\n 19 14  1  0  0  0  0\n 20 19  2  0  0  0  0\n 21 19  1  0  0  0  0\n 22 21  2  0  0  0  0\n 23 20  1  0  0  0  0\n 24 22  1  0  0  0  0\n  2 25  1  6  0  0  0\n  7  6  1  0  0  0  0\n  2  4  1  0  0  0  0\n 23 24  2  0  0  0  0\nM  END",
        "smiles": "CC1(C)[C@H](C(=O)O)N2C(=O)[C@H]([C@@]2([H])S1)NC(=O)COc3ccccc3",
        "formula": "C16H18N2O5S",
        "atropisomerism": "No",
        "charge": 0,
        "count": 1,
        "stereochemistry": "ABSOLUTE",
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        "ez_centers": 0,
        "molecular_weight": "350.3912",
        "optical_activity": "UNSPECIFIED",
        "references": [
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          "27ffb0a2-0c48-42b8-9dce-729fb8485b1d",
          "d66d3f94-1a7d-4ec7-9fd5-fbcde57f7290"
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}