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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 09:19:10 UTC
Update Date2025-03-24 20:16:17 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01392983
Frequency0.9
Structure
Chemical FormulaC5H9NO3
Molecular Mass131.0582
SMILESCC(O)C(N)=CC(=O)O
InChI KeyYHVHIGFPICAUEO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty acids and conjugates
Direct Parent hydroxy fatty acids
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • methyl-branched fatty acids
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary alcohols
  • short-chain hydroxy acids and derivatives
  • unsaturated fatty acids
  • vinylogous amides
  • Substituents
  • alcohol
  • vinylogous amide
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • methyl-branched fatty acid
  • short-chain hydroxy acid
  • carboxylic acid derivative
  • branched fatty acid
  • unsaturated fatty acid
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • hydroxy fatty acid
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound