Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 11:29:10 UTC
Update Date2025-03-24 21:12:13 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01704135
Frequency0.7
Structure
Chemical FormulaC8H13NO
Molecular Mass139.0997
SMILESCC(=O)C1CCC=CN1C
InChI KeyDIOIINOVPVSIAD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass hydropyridines
Direct Parent tetrahydropyridines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • alpha-amino ketones
  • azacyclic compounds
  • enamines
  • hydrocarbon derivatives
  • organic oxides
  • organopnictogen compounds
  • trialkylamines
  • Substituents
  • carbonyl group
  • azacycle
  • tertiary aliphatic amine
  • tetrahydropyridine
  • ketone
  • organic oxide
  • organic oxygen compound
  • alpha-aminoketone
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • tertiary amine
  • organooxygen compound
  • enamine