| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:16:14 UTC |
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| Update Date | 2025-03-25 00:59:37 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02238366 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H10O6 |
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| Molecular Mass | 202.0477 |
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| SMILES | O=C(O)C1=C(O)C(O)C(C(=O)O)CC1 |
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| InChI Key | VRWQGGMBOLSGEW-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 | aliphatic homomonocyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acidsdicarboxylic acids and derivativeshydrocarbon derivativesorganic oxidessecondary alcoholsvinylogous acids |
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| Substituents | alcoholcarbonyl groupcarboxylic acidcarboxylic acid derivativevinylogous acidbeta-hydroxy acidorganic oxideorganic oxygen compoundsecondary alcoholaliphatic homomonocyclic compounddicarboxylic acid or derivativeshydrocarbon derivativeorganooxygen compound |
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