| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:51:52 UTC |
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| Update Date | 2025-03-25 00:50:43 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02182762 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H14O8 |
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| Molecular Mass | 238.0689 |
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| SMILES | O=CC(O)C(OC(CO)C(O)CO)C(=O)O |
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| InChI Key | FLSJERTZCFDXAP-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-hydroxyaldehydescarboxylic acidsdialkyl ethershydrocarbon derivativeshydroxy fatty acidsmonocarboxylic acids and derivativesmonosaccharidesorganic oxidesprimary alcoholssecondary alcoholsshort-chain hydroxy acids and derivatives |
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| Substituents | fatty acylaliphatic acyclic compoundcarbonyl groupethercarboxylic acidshort-chain hydroxy acidmonosaccharidefatty acidcarboxylic acid derivativedialkyl etherbeta-hydroxy acidsaccharideorganic oxidealpha-hydroxyaldehydehydroxy fatty acidprimary alcoholalcoholaldehydemonocarboxylic acid or derivativesorganic oxygen compoundsecondary alcoholhydrocarbon derivativeorganooxygen compound |
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