| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:46:33 UTC |
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| Update Date | 2025-03-21 18:00:58 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00030237 |
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| Frequency | 123.1 |
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| Structure | |
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| Chemical Formula | C8H8O2 |
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| Molecular Mass | 136.0524 |
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| SMILES | CC1=CC(=O)C(=O)C=C1C |
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| InChI Key | KLPBUQXSGNVDJD-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 | hydrocarbon derivativeso-benzoquinonesorganic oxides |
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| Substituents | organic oxideo-benzoquinonealiphatic homomonocyclic compoundhydrocarbon derivativequinone |
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