Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:37:19 UTC
Update Date2025-03-25 00:45:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02149537
Frequency0.5
Structure
Chemical FormulaC6H13N2O3+
Molecular Mass161.0921
SMILESC[N+](C)(CC(N)=O)CC(=O)O
InChI KeyZETVDQASLFFUHE-UHFFFAOYSA-O
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alpha amino acid amides
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alpha amino acids
  • amines
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic cations
  • organic oxides
  • organic salts
  • organopnictogen compounds
  • primary carboxylic acid amides
  • tetraalkylammonium salts
  • Substituents
  • primary carboxylic acid amide
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • alpha-amino acid amide
  • tetraalkylammonium salt
  • quaternary ammonium salt
  • carboxamide group
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • alpha-amino acid
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic cation
  • organic salt
  • amine
  • organooxygen compound