Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:01:58 UTC
Update Date2025-03-21 20:11:15 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00347576
Frequency5.5
Structure
Chemical FormulaC5H11NO2
Molecular Mass117.079
SMILESCN(C)CC(=O)CO
InChI KeyAIECUFDPXWZFSB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbohydrates and carbohydrate conjugates
Direct Parent monosaccharides
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • 1,3-aminoalcohols
  • alcohols and polyols
  • alpha-amino ketones
  • alpha-hydroxy ketones
  • hydrocarbon derivatives
  • organic oxides
  • organopnictogen compounds
  • trialkylamines
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • carbonyl group
  • 1,3-aminoalcohol
  • tertiary aliphatic amine
  • monosaccharide
  • alpha-hydroxy ketone
  • ketone
  • organic oxide
  • alpha-aminoketone
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • tertiary amine