Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:00:01 UTC
Update Date2025-03-25 00:32:06 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02062169
Frequency0.6
Structure
Chemical FormulaC6H13NO2
Molecular Mass131.0946
SMILESCC(O)C(O)C1CN1C
InChI KeyBKAZRXXXFFKJPE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent 1,3-aminoalcohols
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • 1,2-aminoalcohols
  • 1,2-diols
  • azacyclic compounds
  • aziridines
  • hydrocarbon derivatives
  • organopnictogen compounds
  • secondary alcohols
  • trialkylamines
  • Substituents
  • alcohol
  • 1,3-aminoalcohol
  • azacycle
  • 1,2-aminoalcohol
  • tertiary aliphatic amine
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • aziridine
  • tertiary amine
  • organoheterocyclic compound
  • organooxygen compound
  • 1,2-diol