Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:16:12 UTC |
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Update Date | 2025-03-21 18:34:28 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00100995 |
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Frequency | 27.1 |
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Structure | |
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Chemical Formula | C9H14O6 |
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Molecular Mass | 218.079 |
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SMILES | CCC(O)(CC(=O)O)CC(=O)OC(C)=O |
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InChI Key | NAXAOQQJWYKCGU-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 | carboxylic acids and derivatives |
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Subclass | tricarboxylic acids and derivatives |
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Direct Parent | tricarboxylic acids and derivatives |
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Geometric Descriptor | aliphatic acyclic compounds |
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Alternative Parents | carbonyl compoundscarboxylic acid anhydridescarboxylic acidshydrocarbon derivativesorganic oxidestertiary alcohols |
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Substituents | alcoholaliphatic acyclic compoundcarbonyl groupcarboxylic acidtricarboxylic acid or derivativestertiary alcoholorganic oxideorganic oxygen compoundcarboxylic acid anhydridehydrocarbon derivativeorganooxygen compound |
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