{
  "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",
    "results": {
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          "uuid": "49ebc752-cbf3-4bbc-bf3c-27759adb2d5f",
          "code": "94213-67-9",
          "type": "PRIMARY",
          "url": "https://commonchemistry.cas.org/detail?cas_rn=94213-67-9",
          "code_system": "CAS",
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            "e891b8b5-fc47-47f2-91ce-4a4ec5f94c20",
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          "code": "DTXSID401020320",
          "type": "PRIMARY",
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            "PUBLIC_DOMAIN_RELEASE",
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          "citation": "SRS import [6X9K0QRH71]",
          "url": "http://fdasis.nlm.nih.gov/srs/srsdirect.jsp?regno=6X9K0QRH71",
          "doc_type": "SRS",
          "public_domain": true,
          "document_date": 1493392007000,
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          "uuid": "701fa7f0-956d-b991-a126-b5a9e5cd69f1",
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          "doc_type": "STN (SCIFINDER)",
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          "smiles": "[Na+]",
          "formula": "Na",
          "atropisomerism": "No",
          "charge": 1,
          "count": 2,
          "stereochemistry": "ACHIRAL",
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          "smiles": "CCCCCCCC/C=C\\CCCCCCCCOC(=O)C(CC(=O)[O-])S(=O)(=O)[O-]",
          "formula": "C22H38O7S",
          "atropisomerism": "No",
          "charge": -2,
          "count": 1,
          "stereochemistry": "RACEMIC",
          "count_amount": {
            "type": "MOL RATIO",
            "average": 1,
            "units": "MOL RATIO",
            "uuid": "581d4d8d-397d-4f34-bee0-d72fe240780e"
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          "defined_stereo": 0,
          "ez_centers": 1,
          "molecular_weight": "446.5999",
          "optical_activity": "( + / - )",
          "stereo_centers": 1
        }
      ],
      "definition_level": "COMPLETE",
      "uuid": "2010c872-cf03-483a-b2c7-f797ee396fe2",
      "version": "5",
      "structure": {
        "id": "4afa6fdd-6046-4d3d-85ee-47426f8d333d",
        "molfile": "\n  Marvin  01132103552D          \n\n 32 29  0  0  0  0            999 V2000\n   12.1655   -8.3396    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   12.8745   -7.9272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   12.8745   -7.1022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   13.5963   -6.6768    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   13.5963   -5.8518    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   14.3053   -7.1022    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0\n   13.5963   -8.3396    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0\n   14.0088   -7.6178    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   13.1838   -9.0486    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   14.3053   -8.7522    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0\n   11.4437   -7.9272    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   12.1655   -9.1646    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   11.4437   -9.5771    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   10.7346   -9.1646    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   10.0128   -9.5771    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    9.3038   -9.1646    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    8.5820   -9.5771    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.8601   -9.1646    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.1511   -9.5771    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.4293   -9.1646    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.7203   -9.5771    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.9984   -9.1646    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.9984   -8.3396    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.2895   -7.9272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    4.2895   -7.1022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.5676   -6.6768    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.5676   -5.8518    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    2.8586   -5.4393    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    2.8586   -4.6143    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    2.1367   -4.2018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   15.3185   -7.6986    0.0000 Na  0  3  0  0  0  0  0  0  0  0  0  0\n   15.3185   -7.6986    0.0000 Na  0  3  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  1  0  0  0  0\n  4  5  2  0  0  0  0\n  4  6  1  0  0  0  0\n  2  7  1  0  0  0  0\n  7  8  2  0  0  0  0\n  7  9  2  0  0  0  0\n  7 10  1  0  0  0  0\n  1 11  2  0  0  0  0\n  1 12  1  0  0  0  0\n 12 13  1  0  0  0  0\n 13 14  1  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 17 18  1  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 21 22  2  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\n 25 26  1  0  0  0  0\n 26 27  1  0  0  0  0\n 27 28  1  0  0  0  0\n 28 29  1  0  0  0  0\n 29 30  1  0  0  0  0\nM  CHG  4   6  -1  10  -1  31   1  32   1\nM  STY  1   1 MUL\nM  SCN  1   1 HT \nM  SAL   1  2  31  32\nM  SPA   1  1  31\nM  SDI   1  4   14.8985   -8.1186   14.8985   -7.2786\nM  SDI   1  4   15.7385   -7.2786   15.7385   -8.1186\nM  SMT   1 2\nM  END",
        "smiles": "CCCCCCCC/C=C\\CCCCCCCCOC(=O)C(CC(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]",
        "formula": "C22H38O7S.2Na",
        "atropisomerism": "No",
        "charge": 0,
        "count": 1,
        "stereochemistry": "RACEMIC",
        "defined_stereo": 0,
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        "molecular_weight": "492.5794",
        "optical_activity": "( + / - )",
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      "unii": "6X9K0QRH71"
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}