| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:49:39 UTC |
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| Update Date | 2025-03-21 18:02:24 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00037738 |
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| Frequency | 93.1 |
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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)C(O)C(C)C(=O)O |
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| InChI Key | SXVVZFYATORPSX-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 | acyloinsalpha-hydroxy ketonesbeta hydroxy acids and derivativescarboxylic acidsfatty acylshydrocarbon derivativeshydroxy fatty acidsmethyl-branched fatty acidsmonocarboxylic acids and derivativesorganic oxidessecondary alcoholsshort-chain keto acids and derivatives |
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| Substituents | alcoholfatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidmethyl-branched fatty acidshort-chain keto acidhydroxy acidalpha-hydroxy ketonecarboxylic acid derivativebranched fatty acidgamma-keto acidketonebeta-hydroxy acidorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundacyloinsecondary alcoholhydrocarbon derivativehydroxy fatty acidorganooxygen compound |
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