Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:40:04 UTC
Update Date2025-03-25 00:46:34 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02155956
Frequency0.5
Structure
Chemical FormulaC7H14NO3+
Molecular Mass160.0968
SMILESC[N+](C)(C)CC(=O)C(=O)CO
InChI KeyPJMPEUIFZKVYNN-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
  • alcohols and polyols
  • alpha-amino ketones
  • alpha-diketones
  • alpha-hydroxy ketones
  • amines
  • beta-amino ketones
  • beta-hydroxy ketones
  • hydrocarbon derivatives
  • organic cations
  • organic oxides
  • organic salts
  • organopnictogen compounds
  • tetraalkylammonium salts
  • Substituents
  • alcohol
  • beta-hydroxy ketone
  • aliphatic acyclic compound
  • carbonyl group
  • tetraalkylammonium salt
  • quaternary ammonium salt
  • monosaccharide
  • alpha-hydroxy ketone
  • alpha-diketone
  • ketone
  • organic oxide
  • alpha-aminoketone
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic cation
  • beta-aminoketone
  • organic salt
  • amine