Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:47:47 UTC
Update Date2025-03-21 18:01:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00033202
Frequency217.0
Structure
Chemical FormulaC11H13NO3
Molecular Mass207.0895
SMILESO=C(O)CCCNC(=O)c1ccccc1
InChI KeyBOZHPKGNNJPZKV-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
  • benzamides
  • benzoyl derivatives
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • Substituents
  • monocyclic benzene moiety
  • carbonyl group
  • carboxylic acid
  • gamma amino acid or derivatives
  • benzoyl
  • benzoic acid or derivatives
  • carboxamide group
  • benzamide
  • aromatic homomonocyclic compound
  • secondary carboxylic acid amide
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound