Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:10:24 UTC
Update Date2025-03-24 16:42:13 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00939450
Frequency1.5
Structure
Chemical FormulaC5H7NO3
Molecular Mass129.0426
SMILESNC1C(=O)OC=CC1O
InChI KeyRZVJZIAVYZIABS-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
  • carbonyl compounds
  • dihydropyranones
  • enol esters
  • hydrocarbon derivatives
  • lactones
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • secondary alcohols
  • Substituents
  • carbonyl group
  • dihydropyranone
  • lactone
  • organic oxide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • alpha-amino acid
  • pyranone
  • organopnictogen compound
  • enol ester
  • organoheterocyclic compound
  • alcohol
  • alpha-amino acid ester
  • oxacycle
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • pyran
  • carboxylic acid ester
  • secondary alcohol
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound