{
  "meta": {
    "disclaimer": "Do not rely on openFDA to make decisions regarding medical care. While we make every effort to ensure that data is accurate, you should assume all results are unvalidated. We may limit or otherwise restrict your access to the API in line with our Terms of Service.",
    "terms": "https://open.fda.gov/terms/",
    "license": "https://open.fda.gov/license/",
    "last_updated": "2025-09-19",
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          "smiles": "[Mg+2]",
          "formula": "Mg",
          "atropisomerism": "No",
          "charge": 2,
          "count": 1,
          "stereochemistry": "ACHIRAL",
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          "smiles": "CC(=O)N[C@@H](CCSC)C(=O)[O-]",
          "formula": "C7H12NO3S",
          "atropisomerism": "No",
          "charge": -1,
          "count": 2,
          "stereochemistry": "ABSOLUTE",
          "count_amount": {
            "type": "MOL RATIO",
            "average": 2,
            "units": "MOL RATIO",
            "uuid": "c4f22f98-e58f-4868-be35-369f7ce1e414"
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          "defined_stereo": 1,
          "ez_centers": 0,
          "molecular_weight": "190.2414",
          "optical_activity": "UNSPECIFIED",
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      "definition_level": "COMPLETE",
      "uuid": "62e3ae8a-d10e-4c1c-966e-3f8524f01808",
      "version": "4",
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        "molfile": "\n  Marvin  01132105532D          \n\n 25 22  0  0  1  0            999 V2000\n   18.5944   -8.6504    0.0000 Mg  0  2  0  0  0  0  0  0  0  0  0  0\n   13.7353  -10.1198    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   13.3229  -10.8343    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   14.5604  -10.1198    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   13.3229   -9.4053    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n   13.7353   -8.6908    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0\n   13.3229   -7.9764    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   13.7353   -7.2619    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   12.4978   -7.9764    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0\n   14.5604   -8.6908    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   14.9729   -7.9764    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   15.7979   -7.9764    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0\n   16.2104   -7.2619    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   13.7353  -10.1198    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   13.3229  -10.8343    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   14.5604  -10.1198    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   13.3229   -9.4053    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n   13.7353   -8.6908    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0\n   13.3229   -7.9764    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   13.7353   -7.2619    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   12.4978   -7.9764    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0\n   14.5604   -8.6908    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   14.9729   -7.9764    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   15.7979   -7.9764    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0\n   16.2104   -7.2619    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n  2  3  1  0  0  0  0\n  2  4  2  0  0  0  0\n  2  5  1  0  0  0  0\n  6  5  1  6  0  0  0\n  6  7  1  0  0  0  0\n  7  8  2  0  0  0  0\n  7  9  1  0  0  0  0\n  6 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 14 15  1  0  0  0  0\n 14 16  2  0  0  0  0\n 14 17  1  0  0  0  0\n 18 17  1  6  0  0  0\n 18 19  1  0  0  0  0\n 18 22  1  0  0  0  0\n 19 20  2  0  0  0  0\n 19 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\nM  CHG  3   1   2   9  -1  21  -1\nM  STY  1   1 MUL\nM  SCN  1   1 HT \nM  SAL   1 15   2   3   4   5   6   7   8   9  10  11  12  13  14  15  16\nM  SAL   1  9  17  18  19  20  21  22  23  24  25\nM  SPA   1 12   2   3   4   5   6   7   8   9  10  11  12  13\nM  SDI   1  4   12.0778  -11.2543   12.0778   -6.8419\nM  SDI   1  4   16.6304   -6.8419   16.6304  -11.2543\nM  SMT   1 2\nM  END",
        "smiles": "CC(=O)N[C@@H](CCSC)C(=O)[O-].CC(=O)N[C@@H](CCSC)C(=O)[O-].[Mg+2]",
        "formula": "2C7H12NO3S.Mg",
        "atropisomerism": "No",
        "charge": 0,
        "count": 1,
        "stereochemistry": "ABSOLUTE",
        "defined_stereo": 2,
        "ez_centers": 0,
        "molecular_weight": "404.7879",
        "optical_activity": "UNSPECIFIED",
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      "unii": "6W5T59494V"
    }
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}