Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 10:43:56 UTC
Update Date2025-03-24 20:52:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01595388
Frequency0.8
Structure
Chemical FormulaC6H11NO
Molecular Mass113.0841
SMILESOC1CC2CNC2C1
InChI KeyGFJJNAGSDVLGHR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazepanes
Subclass azepanes
Direct Parent azepanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • azetidines
  • cyclic alcohols and derivatives
  • dialkylamines
  • hydrocarbon derivatives
  • organopnictogen compounds
  • secondary alcohols
  • Substituents
  • alcohol
  • secondary aliphatic amine
  • azacycle
  • cyclic alcohol
  • secondary amine
  • azetidine
  • aliphatic heteropolycyclic compound
  • azepane
  • organic oxygen compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine