Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:25:47 UTC
Update Date2025-03-24 14:19:20 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00832689
Frequency1.8
Structure
Chemical FormulaC5H7NO3
Molecular Mass129.0426
SMILESCN1CC(=O)OCC1=O
InChI KeyALEQTISJLWGNDS-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 heteromonocyclic compounds
Alternative Parents
  • alpha amino acids
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acid esters
  • hydrocarbon derivatives
  • lactams
  • lactones
  • monocarboxylic acids and derivatives
  • morpholines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • tertiary carboxylic acid amides
  • Substituents
  • carbonyl group
  • lactam
  • lactone
  • organic oxide
  • tertiary carboxylic acid amide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • organoheterocyclic compound
  • alpha-amino acid ester
  • azacycle
  • carboxamide group
  • oxazinane
  • oxacycle
  • morpholine
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound