Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 10:10:48 UTC
Update Date2025-03-24 20:38:34 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01515914
Frequency0.8
Structure
Chemical FormulaC6H13NO2
Molecular Mass131.0946
SMILESCNC(C)C(O)C(C)=O
InChI KeyFWHFFHMMPQAUGA-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
  • acyloins
  • alpha-hydroxy ketones
  • dialkylamines
  • hydrocarbon derivatives
  • organic oxides
  • organopnictogen compounds
  • secondary alcohols
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • secondary aliphatic amine
  • carbonyl group
  • monosaccharide
  • secondary amine
  • alpha-hydroxy ketone
  • ketone
  • organic oxide
  • acyloin
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine