Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:03:39 UTC
Update Date2025-03-25 00:54:57 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02209671
Frequency0.5
Structure
Chemical FormulaC7H16NO3+
Molecular Mass162.1125
SMILESCC(O)C(=O)C(O)[N+](C)(C)C
InChI KeyVHHJIRNTSGFFIO-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
  • alkanolamines
  • alpha-hydroxy ketones
  • hydrocarbon derivatives
  • organic cations
  • organic oxides
  • organic salts
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary alcohols
  • tetraalkylammonium salts
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • carbonyl group
  • tetraalkylammonium salt
  • monosaccharide
  • alpha-hydroxy ketone
  • ketone
  • organic oxide
  • acyloin
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic cation
  • organic salt
  • alkanolamine