Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 13:06:51 UTC
Update Date2025-03-24 21:55:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01935671
Frequency0.6
Structure
Chemical FormulaC7H13NO
Molecular Mass127.0997
SMILESCN1CC=C(CO)CC1
InChI KeyXCZCVUOQSMDKQW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent trialkylamines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • alcohols and polyols
  • azacyclic compounds
  • hydrocarbon derivatives
  • organopnictogen compounds
  • Substituents
  • alcohol
  • azacycle
  • tertiary aliphatic amine
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organoheterocyclic compound
  • organooxygen compound