Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:51:35 UTC
Update Date2025-03-21 18:03:07 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00042315
Frequency80.8
Structure
Chemical FormulaC5H13NO2
Molecular Mass119.0946
SMILESCN(C)CC(O)CO
InChI KeyQCMHUGYTOGXZIW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent 1,3-aminoalcohols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • 1,2-aminoalcohols
  • 1,2-diols
  • hydrocarbon derivatives
  • organopnictogen compounds
  • primary alcohols
  • secondary alcohols
  • trialkylamines
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • 1,3-aminoalcohol
  • 1,2-aminoalcohol
  • tertiary aliphatic amine
  • organic oxygen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • primary alcohol
  • tertiary amine
  • organooxygen compound
  • 1,2-diol