Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:58:43 UTC
Update Date2025-03-24 19:50:07 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01055093
Frequency1.3
Structure
Chemical FormulaC6H12NO2+
Molecular Mass130.0863
SMILESCC(C)=[N+](C)CC(=O)O
InChI KeySXVPEVAPVDWDIG-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 acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic cations
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary ketimines
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • secondary ketimine
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • alpha-amino acid
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic cation
  • organooxygen compound