| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:41:13 UTC |
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| Update Date | 2025-03-21 17:58:59 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00018026 |
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| Frequency | 231.2 |
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| Structure | |
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| Chemical Formula | C4H4O4 |
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| Molecular Mass | 116.011 |
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| SMILES | O=CCC(=O)C(=O)O |
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| InChI Key | YEZSWHPLZBZVLH-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | keto acids and derivatives |
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| Subclass | gamma-keto acids and derivatives |
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| Direct Parent | 3-acylpyruvic acids |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alpha-hydrogen aldehydesalpha-hydroxy ketonesalpha-keto acids and derivativesbeta ketoaldehydescarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesshort-chain keto acids and derivatives |
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| Substituents | aliphatic acyclic compoundcarbonyl group3-acylpyruvic acidcarboxylic acidbeta-ketoaldehydeshort-chain keto acidaldehydealpha-hydroxy ketonecarboxylic acid derivativeketoneorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundalpha-hydrogen aldehydealpha-keto acidhydrocarbon derivativeorganooxygen compound |
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