Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 08:33:53 UTC
Update Date2025-03-25 00:20:14 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01285188
Frequency1.0
Structure
Chemical FormulaC5H9NO3
Molecular Mass131.0582
SMILESCC(=O)COC(=O)CN
InChI KeyLONPIEVDXPRDMR-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
  • alpha-acyloxy ketones
  • carboxylic acid esters
  • hydrocarbon derivatives
  • ketones
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • alpha-acyloxy ketone
  • alpha-amino acid ester
  • ketone
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound