Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 08:56:52 UTC
Update Date2025-03-24 20:06:28 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01339950
Frequency1.0
Structure
Chemical FormulaC8H13NO
Molecular Mass139.0997
SMILESCC1CCC2CC=NC2O1
InChI KeyJEQARYRLLOHZMJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classoxanes
Subclass oxanes
Direct Parent oxanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • hydrocarbon derivatives
  • imines
  • organooxygen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • propargyl-type 1,3-dipolar organic compounds
  • pyrrolines
  • Substituents
  • azacycle
  • imine
  • organic 1,3-dipolar compound
  • propargyl-type 1,3-dipolar organic compound
  • aliphatic heteropolycyclic compound
  • oxacycle
  • pyrroline
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • oxane
  • organooxygen compound