Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:51:44 UTC
Update Date2025-03-21 22:58:58 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00608394
Frequency2.7
Structure
Chemical FormulaC7H11NO2
Molecular Mass141.079
SMILESCCNC1=C(O)CCC1=O
InChI KeyWUUYEPLHPJRXET-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classvinylogous acids
Subclass vinylogous acids
Direct Parent vinylogous acids
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • cyclic ketones
  • dialkylamines
  • hydrocarbon derivatives
  • organic oxides
  • organopnictogen compounds
  • Substituents
  • secondary aliphatic amine
  • carbonyl group
  • cyclic ketone
  • secondary amine
  • ketone
  • vinylogous acid
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • aliphatic homomonocyclic compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine