Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:41:28 UTC
Update Date2025-03-24 14:32:18 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00869903
Frequency1.7
Structure
Chemical FormulaC5H9NO2
Molecular Mass115.0633
SMILESCC1(N)CCOC1=O
InChI KeyJQSYTXVDEHQTNZ-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
  • carbonyl compounds
  • carboxylic acid esters
  • gamma butyrolactones
  • hydrocarbon derivatives
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • tetrahydrofurans
  • Substituents
  • carbonyl group
  • tetrahydrofuran
  • gamma butyrolactone
  • lactone
  • oxacycle
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organoheterocyclic compound
  • organooxygen compound