Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:22:42 UTC
Update Date2025-03-21 23:15:31 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00680802
Frequency2.3
Structure
Chemical FormulaC7H13NO
Molecular Mass127.0997
SMILESCN1CC2CCC(C1)O2
InChI KeyXJZDIZQNHVHDKM-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
  • hydrocarbon derivatives
  • morpholines
  • organopnictogen compounds
  • oxacyclic compounds
  • tetrahydrofurans
  • trialkylamines
  • Substituents
  • ether
  • azacycle
  • tetrahydrofuran
  • tertiary aliphatic amine
  • dialkyl ether
  • oxazinane
  • aliphatic heteropolycyclic compound
  • oxacycle
  • morpholine
  • azepane
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • tertiary amine
  • organooxygen compound