Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:21:48 UTC
Update Date2025-03-25 01:01:43 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02251261
Frequency0.5
Structure
Chemical FormulaC6H11NO2
Molecular Mass129.079
SMILESOC(O)C1CCC=CN1
InChI KeyJIUNNOJDDMOOJV-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 hydrates
  • dialkylamines
  • hydrocarbon derivatives
  • organooxygen compounds
  • organopnictogen compounds
  • Substituents
  • secondary aliphatic amine
  • carbonyl hydrate
  • azacycle
  • tetrahydropyridine
  • secondary amine
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine