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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:57:44 UTC
Update Date2025-03-25 00:52:47 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02196021
Frequency0.5
Structure
Chemical FormulaC8H12O8
Molecular Mass236.0532
SMILESCC1(O)C(O)C(O)OC(C(=O)O)C1C(=O)O
InChI KeyLSQXYMUAOJUNID-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbohydrates and carbohydrate conjugates
Direct Parent glucuronic acid derivatives
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • 1,2-diols
  • carbonyl compounds
  • carboxylic acids
  • dicarboxylic acids and derivatives
  • hemiacetals
  • hydrocarbon derivatives
  • monosaccharides
  • organic oxides
  • oxacyclic compounds
  • oxanes
  • pyran carboxylic acids
  • secondary alcohols
  • tertiary alcohols
    • Substituents
  • alcohol
  • carbonyl group
  • carboxylic acid
  • pyran carboxylic acid or derivatives
  • glucuronic acid or derivatives
  • monosaccharide
  • carboxylic acid derivative
  • pyran carboxylic acid
  • oxacycle
  • tertiary alcohol
  • organic oxide
  • pyran
  • aliphatic heteromonocyclic compound
  • secondary alcohol
  • dicarboxylic acid or derivatives
  • hemiacetal
  • hydrocarbon derivative
  • oxane
  • organoheterocyclic compound
  • 1,2-diol