Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:20:38 UTC
Update Date2025-03-21 23:14:34 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00675807
Frequency2.3
Structure
Chemical FormulaC4H5NO3
Molecular Mass115.0269
SMILESO=C(O)C1NCC1=O
InChI KeyZVOFYZLRYPSKBB-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 heteromonocyclic compounds
Alternative Parents
  • 1,3-dicarbonyl compounds
  • amino acids
  • azacyclic compounds
  • azetidinecarboxylic acids
  • azetidines
  • carboxylic acids
  • cyclic ketones
  • dialkylamines
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • Substituents
  • carbonyl group
  • carboxylic acid
  • amino acid
  • azetidinecarboxylic acid
  • cyclic ketone
  • ketone
  • organic oxide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • organoheterocyclic compound
  • secondary aliphatic amine
  • azacycle
  • secondary amine
  • azetidine
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • 1,3-dicarbonyl compound
  • organooxygen compound
  • amine