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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:22:50 UTC
Update Date2025-03-21 18:37:46 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00117226
Frequency22.4
Structure
Chemical FormulaC12H20N2O7
Molecular Mass304.1271
SMILESCC(=O)NC1C(O)CC(O)(C(=O)O)CC(O)C1NC(C)=O
InChI KeyQFVGYIDGUCRHHS-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
  • acetamides
  • carbonyl compounds
  • carboxylic acids
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary alcohols
  • secondary carboxylic acid amides
  • tertiary alcohols
  • Substituents
  • alcohol
  • carbonyl group
  • carboxylic acid
  • alpha-hydroxy acid
  • cyclic alcohol
  • carboxamide group
  • carboxylic acid derivative
  • secondary carboxylic acid amide
  • tertiary alcohol
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • acetamide
  • organooxygen compound