| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 01:27:51 UTC |
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| Update Date | 2025-03-21 19:17:52 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00268612 |
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| Frequency | 7.6 |
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| Structure | |
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| Chemical Formula | C7H8O3 |
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| Molecular Mass | 140.0473 |
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| SMILES | CC1=CC(=O)CC(=O)C1O |
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| InChI Key | PNWIDZGZSGHQGM-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 | cyclohexenoneshydrocarbon derivativesm-benzoquinonesorganic oxidessecondary alcohols |
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| Substituents | alcoholcyclohexenoneorganic oxidesecondary alcoholaliphatic homomonocyclic compoundhydrocarbon derivativem-benzoquinonequinone |
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