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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:43:28 UTC
Update Date2025-03-25 00:47:42 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02163507
Frequency0.5
Structure
Chemical FormulaC8H12O7
Molecular Mass220.0583
SMILESO=C(O)C(O)(O)C1=CC(O)C(O)C(O)C1
InChI KeyHOZSIDVJDISKKC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classhydroxy acids and derivatives
Subclass alpha hydroxy acids and derivatives
Direct Parent alpha hydroxy acids and derivatives
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carbonyl hydrates
  • carboxylic acids
  • cyclitols and derivatives
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • secondary alcohols
  • Substituents
  • alcohol
  • carbonyl group
  • carboxylic acid
  • carbonyl hydrate
  • alpha-hydroxy acid
  • cyclitol or derivatives
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • organooxygen compound