Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:15:21 UTC
Update Date2025-03-25 00:59:19 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02236398
Frequency0.5
Structure
Chemical FormulaC11H20NO2+
Molecular Mass198.1489
SMILESC[N+](C)(C)C(C(=O)O)C1C=CCCC1
InChI KeyYTLLPIPBLXGUHK-UHFFFAOYSA-O
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alpha amino acids
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • amines
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic cations
  • organic oxides
  • organic salts
  • organopnictogen compounds
  • tetraalkylammonium salts
  • Substituents
  • carbonyl group
  • carboxylic acid
  • tetraalkylammonium salt
  • quaternary ammonium salt
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • alpha-amino acid
  • organonitrogen compound
  • aliphatic homomonocyclic compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic cation
  • organic salt
  • amine
  • organooxygen compound