Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:12:32 UTC
Update Date2025-03-25 00:58:19 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02229930
Frequency0.5
Structure
Chemical FormulaC12H23NO2
Molecular Mass213.1729
SMILESCCCCCC(O)C(=C=O)N(CC)CC
InChI KeyDHUMYYSYZWVPIH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent trialkylamines
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organic oxides
  • organopnictogen compounds
  • secondary alcohols
  • ynolates
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • tertiary aliphatic amine
  • organic oxide
  • organic oxygen compound
  • ynolate
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organooxygen compound