Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-20 23:37:53 UTC |
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Update Date | 2025-03-21 17:57:50 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00010537 |
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Frequency | 446.2 |
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Structure | |
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Chemical Formula | C10H12O6 |
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Molecular Mass | 228.0634 |
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SMILES | O=C(O)C(O)C(O)Cc1ccc(O)c(O)c1 |
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InChI Key | VRIYWHWRWOJWOH-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 | hydroxy acids and derivatives |
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Subclass | beta hydroxy acids and derivatives |
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Direct Parent | beta hydroxy acids and derivatives |
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Geometric Descriptor | aromatic homomonocyclic compounds |
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Alternative Parents | 1,2-diols1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsalpha hydroxy acids and derivativesbenzene and substituted derivativescarbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesmonosaccharidesorganic oxidessecondary alcohols |
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Substituents | alcoholmonocyclic benzene moietycarbonyl groupcarboxylic acidalpha-hydroxy acid1-hydroxy-2-unsubstituted benzenoidmonosaccharide1-hydroxy-4-unsubstituted benzenoidcarboxylic acid derivativearomatic homomonocyclic compoundbeta-hydroxy acidsaccharideorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundsecondary alcoholphenolhydrocarbon derivativebenzenoidorganooxygen compound1,2-diol |
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