| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:23:19 UTC |
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| Update Date | 2025-03-21 18:38:00 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00118414 |
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| Frequency | 22.1 |
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| Structure | |
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| Chemical Formula | C7H6O4 |
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| Molecular Mass | 154.0266 |
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| SMILES | O=C1C=C(C(=O)O)CC(=O)C1 |
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| InChI Key | BUTLJJZFRHZBCM-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | carbonyl compounds |
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| Direct Parent | quinones |
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| Geometric Descriptor | aliphatic homomonocyclic compounds |
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| Alternative Parents | carboxylic acidscyclohexenoneshydrocarbon derivativesm-benzoquinonesmonocarboxylic acids and derivativesorganic oxides |
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| Substituents | cyclohexenonecarboxylic acidcarboxylic acid derivativeorganic oxidemonocarboxylic acid or derivativesaliphatic homomonocyclic compoundhydrocarbon derivativem-benzoquinonequinone |
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