Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:29:24 UTC
Update Date2025-03-21 18:41:09 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00132736
Frequency19.0
Structure
Chemical FormulaC7H16NO3+
Molecular Mass162.1125
SMILESC[N+](C)(C)CC(CO)C(=O)O
InChI KeyWFHPMAKSQNTWKG-UHFFFAOYSA-O
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classhydroxy acids and derivatives
Subclass beta hydroxy acids and derivatives
Direct Parent beta hydroxy acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • 1,3-aminoalcohols
  • amines
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic cations
  • organic oxides
  • organic salts
  • organopnictogen compounds
  • primary alcohols
  • tetraalkylammonium salts
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • 1,3-aminoalcohol
  • tetraalkylammonium salt
  • quaternary ammonium salt
  • carboxylic acid derivative
  • beta-hydroxy acid
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic cation
  • organic salt
  • primary alcohol
  • amine
  • organooxygen compound