Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 12:16:57 UTC
Update Date2025-03-24 21:33:53 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01818192
Frequency0.7
Structure
Chemical FormulaC6H11NO3
Molecular Mass145.0739
SMILESCCC(=O)OCC(=O)CN
InChI KeyONPKMKZINFUGAF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent alpha-acyloxy ketones
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carboxylic acid esters
  • hydrocarbon derivatives
  • ketones
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • alpha-acyloxy ketone
  • carboxylic acid derivative
  • ketone
  • organic oxide
  • monocarboxylic acid or derivatives
  • carboxylic acid ester
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound