Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:05:00 UTC
Update Date2025-03-24 14:11:01 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00782546
Frequency1.9
Structure
Chemical FormulaC5H7NO2
Molecular Mass113.0477
SMILESO=C(O)C1NC2CC21
InChI KeyAKJQPUQZMLLGFC-UHFFFAOYSA-N
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 heteropolycyclic compounds
Alternative Parents
  • amino acids
  • azacyclic compounds
  • azetidinecarboxylic acids
  • azetidines
  • carbonyl compounds
  • carboxylic acids
  • dialkylamines
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • pyrrolidine carboxylic acids
  • Substituents
  • carbonyl group
  • carboxylic acid
  • amino acid
  • azetidinecarboxylic acid
  • aliphatic heteropolycyclic compound
  • organic oxide
  • pyrrolidine carboxylic acid
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • pyrrolidine
  • organoheterocyclic compound
  • secondary aliphatic amine
  • azacycle
  • secondary amine
  • azetidine
  • monocarboxylic acid or derivatives
  • pyrrolidine carboxylic acid or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine