Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:05:53 UTC
Update Date2025-03-24 14:11:22 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00784644
Frequency1.9
Structure
Chemical FormulaC7H9NO2
Molecular Mass139.0633
SMILESCC1=C(C(N)=O)C(=O)CC1
InChI KeyHJMJELYLJYEBSG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass carboxylic acid derivatives
Direct Parent primary carboxylic acid amides
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • carboxylic acids and derivatives
  • cyclic ketones
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • primary carboxylic acid amide
  • carbonyl group
  • cyclic ketone
  • ketone
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • aliphatic homomonocyclic compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound