Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:10:22 UTC
Update Date2025-03-21 18:31:39 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00086945
Frequency32.7
Structure
Chemical FormulaC10H17NO
Molecular Mass167.131
SMILESC=CC1(O)CN2CCCC1CC2
InChI KeyMHDGFJRFCLYLBA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazepanes
Subclass azepanes
Direct Parent azepanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • hydrocarbon derivatives
  • organopnictogen compounds
  • piperidines
  • tertiary alcohols
  • trialkylamines
  • Substituents
  • alcohol
  • azacycle
  • tertiary aliphatic amine
  • aliphatic heteropolycyclic compound
  • tertiary alcohol
  • azepane
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • piperidine
  • amine
  • tertiary amine
  • organooxygen compound