Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 09:17:42 UTC
Update Date2025-03-24 20:15:28 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01389477
Frequency0.9
Structure
Chemical FormulaC5H9NO
Molecular Mass99.0684
SMILESOC1C=CNCC1
InChI KeyFGTYPPVXKJSFPR-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
  • dialkylamines
  • hydrocarbon derivatives
  • organopnictogen compounds
  • secondary alcohols
  • Substituents
  • alcohol
  • secondary aliphatic amine
  • azacycle
  • tetrahydropyridine
  • secondary amine
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine