| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:36:05 UTC |
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| Update Date | 2025-03-21 17:57:12 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00006329 |
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| Frequency | 818.4 |
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| Structure | |
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| Chemical Formula | C6H10O7 |
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| Molecular Mass | 194.0427 |
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| SMILES | O=C(O)CC(O)(C(=O)O)C(O)CO |
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| InChI Key | XRQZKIYUKGUULI-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 acyclic compounds |
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| Alternative Parents | alpha hydroxy acids and derivativesbranched fatty acidscarbonyl compoundscarboxylic acidsdicarboxylic acids and derivativeshydrocarbon derivativeshydroxy fatty acidsmonosaccharidesorganic oxidesprimary alcoholssecondary alcoholsshort-chain hydroxy acids and derivativestertiary alcohols |
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| Substituents | alcoholfatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidshort-chain hydroxy acidalpha-hydroxy acidmonosaccharidefatty acidcarboxylic acid derivativebranched fatty acidbeta-hydroxy acidtertiary alcoholsaccharideorganic oxideorganic oxygen compoundsecondary alcoholdicarboxylic acid or derivativeshydrocarbon derivativehydroxy fatty acidprimary alcoholorganooxygen compound |
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