Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:25:36 UTC
Update Date2025-03-21 20:55:28 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00403665
Frequency4.5
Structure
Chemical FormulaC6H13NO
Molecular Mass115.0997
SMILESOC1CCCNCC1
InChI KeyJKYGZQCMFANMFM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazepanes
Subclass azepanes
Direct Parent azepanes
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • dialkylamines
  • hydrocarbon derivatives
  • organopnictogen compounds
  • secondary alcohols
  • Substituents
  • alcohol
  • secondary aliphatic amine
  • azacycle
  • secondary amine
  • azepane
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine