| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:12:09 UTC |
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| Update Date | 2025-03-21 18:32:30 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00091153 |
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| Frequency | 30.8 |
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| Structure | |
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| Chemical Formula | C6H10O4 |
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| Molecular Mass | 146.0579 |
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| SMILES | CC(=O)CC(CO)C(=O)O |
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| InChI Key | ZJNGFNRGYQOQCJ-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 | gamma-keto acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | beta hydroxy acids and derivativesbranched fatty acidscarboxylic acidsfatty acylshydrocarbon derivativeshydroxy fatty acidsketonesmonocarboxylic acids and derivativesorganic oxidesprimary alcoholsshort-chain keto acids and derivatives |
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| Substituents | alcoholfatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidshort-chain keto acidhydroxy acidcarboxylic acid derivativebranched fatty acidgamma-keto acidketonebeta-hydroxy acidorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativehydroxy fatty acidprimary alcoholorganooxygen compound |
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