Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:24:52 UTC |
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Update Date | 2025-03-21 18:38:39 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00122048 |
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Frequency | 21.2 |
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Structure | |
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Chemical Formula | C15H16O9 |
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Molecular Mass | 340.0794 |
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SMILES | O=C(O)CC(O)(CC(=O)OC(Cc1ccccc1)C(=O)O)C(=O)O |
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InChI Key | DYBLXDOLGYENIS-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 | tetracarboxylic acids and derivatives |
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Direct Parent | tetracarboxylic acids and derivatives |
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Geometric Descriptor | aromatic homomonocyclic compounds |
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Alternative Parents | alpha hydroxy acids and derivativesbenzene and substituted derivativescarbonyl compoundscarboxylic acid esterscarboxylic acidsfatty acid estershydrocarbon derivativesorganic oxidesphenylpropanoic acidstertiary alcohols |
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Substituents | alcoholfatty acylmonocyclic benzene moietycarbonyl groupcarboxylic acid3-phenylpropanoic-acidalpha-hydroxy acidtetracarboxylic acid or derivativeshydroxy acidaromatic homomonocyclic compoundfatty acid estertertiary alcoholorganic oxideorganic oxygen compoundcarboxylic acid esterhydrocarbon derivativebenzenoidorganooxygen compound |
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