Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-20 23:35:52 UTC |
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Update Date | 2025-03-21 17:57:07 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00005826 |
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Frequency | 903.8 |
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Structure | |
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Chemical Formula | C8H8O6 |
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Molecular Mass | 200.0321 |
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SMILES | O=C(O)C(O)c1cc(O)c(O)c(O)c1 |
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InChI Key | GKNXKVFCNOWHDA-UHFFFAOYSA-N |
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Chemical Taxonomy |
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Kingdom | organic compounds |
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Superclass | benzenoids |
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Class | phenols |
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Subclass | benzenetriols and derivatives |
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Direct Parent | pyrogallols and derivatives |
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Geometric Descriptor | aromatic homomonocyclic compounds |
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Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsalpha hydroxy acids and derivativesaromatic alcoholsbenzene and substituted derivativescarbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidessecondary alcohols |
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Substituents | aromatic alcoholalcoholmonocyclic benzene moietycarbonyl groupcarboxylic acidpyrogallol derivativealpha-hydroxy acid1-hydroxy-2-unsubstituted benzenoidhydroxy acid1-hydroxy-4-unsubstituted benzenoidcarboxylic acid derivativearomatic homomonocyclic compoundorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundsecondary alcoholhydrocarbon derivativeorganooxygen compound |
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