Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:20:32 UTC
Update Date2025-03-25 00:39:35 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02110796
Frequency0.6
Structure
Chemical FormulaC7H13NO
Molecular Mass127.0997
SMILESOC1C2CCCN1CC2
InChI KeyWYGXHWHYVHRFNV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazepanes
Subclass azepanes
Direct Parent azepanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • hemiaminals
  • hydrocarbon derivatives
  • n-alkylpyrrolidines
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • piperidines
  • Substituents
  • azacycle
  • n-alkylpyrrolidine
  • hemiaminal
  • aliphatic heteropolycyclic compound
  • azepane
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • pyrrolidine
  • piperidine
  • organooxygen compound
  • alkanolamine