Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:57:53 UTC
Update Date2025-03-21 22:02:39 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00480044
Frequency3.6
Structure
Chemical FormulaC5H13NO2
Molecular Mass119.0946
SMILESCNC(C)(CO)CO
InChI KeyKKTHJBQQGYXBEC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent dialkylamines
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alcohols and polyols
  • hydrocarbon derivatives
  • organopnictogen compounds
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • secondary aliphatic amine
  • organic oxygen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organooxygen compound