Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 09:31:05 UTC
Update Date2025-03-24 20:21:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01421884
Frequency0.9
Structure
Chemical FormulaC7H13NO
Molecular Mass127.0997
SMILESCN(C)C1CCCC1=O
InChI KeyCMRKAVCMNZXAHC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent trialkylamines
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • cyclic ketones
  • hydrocarbon derivatives
  • organic oxides
  • organopnictogen compounds
  • Substituents
  • carbonyl group
  • tertiary aliphatic amine
  • cyclic ketone
  • ketone
  • organic oxide
  • organic oxygen compound
  • aliphatic homomonocyclic compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organooxygen compound