Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:59:16 UTC
Update Date2025-03-24 19:50:21 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01056348
Frequency1.3
Structure
Chemical FormulaC5H9NO3
Molecular Mass131.0582
SMILESCCOC(=O)CNC=O
InChI KeyGMBCCEOJUWMBPF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alpha amino acid esters
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alpha amino acids
  • carbonyl compounds
  • carboxylic acid esters
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • n-formyl-alpha amino acids
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • alpha-amino acid ester
  • carboxamide group
  • secondary carboxylic acid amide
  • organic oxide
  • monocarboxylic acid or derivatives
  • n-formyl-alpha-amino acid
  • organic oxygen compound
  • carboxylic acid ester
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • hydrocarbon derivative
  • n-formyl-alpha amino acid or derivatives
  • organic nitrogen compound
  • organooxygen compound