Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:03:36 UTC
Update Date2025-03-21 22:08:04 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00493835
Frequency3.5
Structure
Chemical FormulaC7H12NO+
Molecular Mass126.0913
SMILESC[N+]1(C)C=CCCC1=O
InChI KeyIKLOFFYUTJVLFU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass hydropyridines
Direct Parent tetrahydropyridines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic cations
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • carbonyl group
  • azacycle
  • tetrahydropyridine
  • carboxylic acid derivative
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic cation
  • organooxygen compound