Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:42:59 UTC |
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Update Date | 2025-03-25 00:47:32 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02162387 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C8H12O8 |
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Molecular Mass | 236.0532 |
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SMILES | O=C(O)CCC(CC(O)(O)C(=O)O)C(=O)O |
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InChI Key | QXRQRBDCGKYOMD-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 | alpha hydroxy acids and derivativescarbonyl compoundscarbonyl hydratescarboxylic acidshydrocarbon derivativesorganic oxides |
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Substituents | aliphatic acyclic compoundcarbonyl groupcarboxylic acidcarbonyl hydratealpha-hydroxy acidtricarboxylic acid or derivativeshydroxy acidorganic oxideorganic oxygen compoundhydrocarbon derivativeorganooxygen compound |
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