Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:03:47 UTC
Update Date2025-03-21 18:28:21 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00071221
Frequency42.2
Structure
Chemical FormulaC9H15NO
Molecular Mass153.1154
SMILESCN1C2CCCCC1C1OC12
InChI KeyGHGRGKKBMOFELU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazepanes
Subclass azepanes
Direct Parent azepanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • dialkyl ethers
  • epoxides
  • hydrocarbon derivatives
  • morpholines
  • n-alkylpyrrolidines
  • organopnictogen compounds
  • oxacyclic compounds
  • trialkylamines
  • Substituents
  • ether
  • azacycle
  • n-alkylpyrrolidine
  • tertiary aliphatic amine
  • oxirane
  • dialkyl ether
  • oxazinane
  • aliphatic heteropolycyclic compound
  • oxacycle
  • morpholine
  • azepane
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • pyrrolidine
  • amine
  • tertiary amine
  • organooxygen compound