| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:00:50 UTC |
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| Update Date | 2025-03-25 00:53:57 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02203153 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H8O6 |
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| Molecular Mass | 200.0321 |
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| SMILES | O=C(O)CC1(O)C=CC(=O)C(O)C1=O |
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| InChI Key | ASNONMGHEBYFLH-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 | acyloinsbeta-diketonescarboxylic acidscyclohexenoneshydrocarbon derivativesm-benzoquinonesmonocarboxylic acids and derivativesorganic oxidessecondary alcoholstertiary alcohols |
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| Substituents | alcoholcyclohexenonecarboxylic acidcarboxylic acid derivativetertiary alcoholorganic oxidemonocarboxylic acid or derivativesacyloinsecondary alcoholaliphatic homomonocyclic compoundhydrocarbon derivative1,3-dicarbonyl compoundm-benzoquinone1,3-diketonequinone |
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