| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:22:05 UTC |
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| Update Date | 2025-03-21 18:37:23 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00115405 |
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| Frequency | 22.8 |
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| Structure | |
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| Chemical Formula | C8H10O8 |
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| Molecular Mass | 234.0376 |
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| SMILES | O=C(O)C1(O)CC(=O)C(O)(C(=O)O)C(O)C1 |
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| InChI Key | LNPYSVNKEGXQAU-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 | acyloinsalpha hydroxy acids and derivativescarboxylic acidscyclic ketonescyclitols and derivativesdicarboxylic acids and derivativeshydrocarbon derivativesorganic oxidessecondary alcoholstertiary alcohols |
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| Substituents | alcoholcarbonyl groupcarboxylic acidalpha-hydroxy acidcyclitol or derivativescyclic ketonecyclic alcoholcarboxylic acid derivativeketonebeta-hydroxy acidtertiary alcoholorganic oxideorganic oxygen compoundacyloinsecondary alcoholaliphatic homomonocyclic compounddicarboxylic acid or derivativeshydrocarbon derivativeorganooxygen compound |
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