{
  "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": "[Ca+2]",
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          "atropisomerism": "No",
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          "stereochemistry": "ACHIRAL",
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          "smiles": "C1(C(=O)NC(=O)N1)NC(=O)N",
          "formula": "C4H6N4O3",
          "atropisomerism": "No",
          "charge": 0,
          "count": 1,
          "stereochemistry": "RACEMIC",
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            "units": "MOL RATIO",
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          "smiles": "CC(C)(C[O-])[C@H](C(=O)NCCC(=O)O)[O-]",
          "formula": "C9H15NO5",
          "atropisomerism": "No",
          "charge": -2,
          "count": 1,
          "stereochemistry": "ABSOLUTE",
          "count_amount": {
            "type": "MOL RATIO",
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            "units": "MOL RATIO",
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          "molecular_weight": "217.2195",
          "optical_activity": "UNSPECIFIED",
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      "definition_level": "COMPLETE",
      "uuid": "0d35153b-c626-4ed7-b75b-d403c1b900d5",
      "version": "7",
      "structure": {
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        "molfile": "\n  Marvin  01132108592D          \n\n 27 25  0  0  1  0            999 V2000\n   -3.1411   -3.2363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -2.4270   -3.6492    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -1.7174   -3.2363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -1.0031   -3.6492    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n   -0.2890   -3.2363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -0.2890   -2.4151    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    0.4253   -3.6492    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0\n    0.4253   -4.4751    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    1.1395   -3.2363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    0.7266   -2.5221    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    1.5524   -2.5221    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    1.8537   -3.6492    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    2.5679   -3.2363    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   -3.1411   -2.4151    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   -3.8554   -3.6492    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   -3.5278    2.3438    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n   -3.0711    1.6578    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -3.3528    0.8849    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   -2.2761    1.8854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -1.6275    1.3756    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n   -1.7471    0.5592    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -1.0985    0.0494    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   -2.5105    0.2527    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n   -2.2761    2.7060    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n   -3.0179    2.9922    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -3.2409    3.7826    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    4.9108   -3.2472    0.0000 Ca  0  2  0  0  0  0  0  0  0  0  0  0\n  9 11  1  0  0  0  0\n  9 12  1  0  0  0  0\n 12 13  1  0  0  0  0\n  1 14  2  0  0  0  0\n  1 15  1  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  1  0  0  0  0\n  5  6  2  0  0  0  0\n  5  7  1  0  0  0  0\n  7  8  1  1  0  0  0\n  7  9  1  0  0  0  0\n 17 16  1  0  0  0  0\n 17 18  2  0  0  0  0\n 19 17  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 21 23  1  0  0  0  0\n 24 19  1  0  0  0  0\n 25 24  1  0  0  0  0\n 25 26  2  0  0  0  0\n 16 25  1  0  0  0  0\n  9 10  1  0  0  0  0\nM  CHG  1  27   2\nM  END",
        "smiles": "CC(C)(CO)[C@H](C(=O)NCCC(=O)O)O.C1(C(=O)NC(=O)N1)NC(=O)N.[Ca+2]",
        "formula": "C9H17NO5.C4H6N4O3.Ca",
        "atropisomerism": "No",
        "charge": 2,
        "count": 1,
        "stereochemistry": "EPIMERIC",
        "defined_stereo": 1,
        "ez_centers": 0,
        "molecular_weight": "417.429",
        "optical_activity": "UNSPECIFIED",
        "references": [
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      "unii": "SM1342S52N"
    }
  ]
}