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Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:43:03 UTC
Update Date2025-03-21 17:59:36 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00022136
Frequency179.5
Structure
Chemical FormulaC10H11NO3
Molecular Mass193.0739
SMILESNC(CC(=O)C(=O)O)c1ccccc1
InChI KeySFUOIRBATYGDMU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent gamma amino acids and derivatives
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • alpha-hydroxy ketones
  • alpha-keto acids and derivatives
  • benzene and substituted derivatives
  • carboxylic acids
  • hydrocarbon derivatives
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • monocyclic benzene moiety
  • carbonyl group
  • carboxylic acid
  • gamma amino acid or derivatives
  • alpha-hydroxy ketone
  • ketone
  • aromatic homomonocyclic compound
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • keto acid
  • organonitrogen compound
  • alpha-keto acid
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound