Record Information |
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HMDB Status | quantified |
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Creation Date | 2024-02-20 23:39:17 UTC |
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Update Date | 2025-03-21 17:58:21 UTC |
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HMDB ID | HMDB0003070 |
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Metabolite Identification |
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DeepMet ID | DMID00013807 |
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Name | Shikimic acid |
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Frequency | 322.0 |
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Structure | |
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Chemical Formula | C7H10O5 |
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Molecular Mass | 174.0528 |
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SMILES | O=C(O)C1=CC(O)C(O)C(O)C1 |
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InChI Key | JXOHGGNKMLTUBP-UHFFFAOYSA-N |
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Chemical Taxonomy |
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Kingdom | organic compounds |
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Superclass | organic oxygen compounds |
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Class | organooxygen compounds |
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Subclass | alcohols and polyols |
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Direct Parent | shikimic acids and derivatves |
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Geometric Descriptor | aliphatic homomonocyclic compounds |
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Alternative Parents | carbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidessecondary alcohols |
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Substituents | carbonyl groupcarboxylic acidcarboxylic acid derivativeshikimic acid or derivativesorganic oxidemonocarboxylic acid or derivativessecondary alcoholaliphatic homomonocyclic compoundhydrocarbon derivative |
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