Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:37:11 UTC
Update Date2025-03-21 22:52:04 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00573627
Frequency2.9
Structure
Chemical FormulaC6H13NO2
Molecular Mass131.0946
SMILESOC1CCCNCC1O
InChI KeyPIOBZIRNQHSVNR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazepanes
Subclass azepanes
Direct Parent azepanes
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • 1,2-diols
  • 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
  • 1,2-diol