Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 08:07:35 UTC
Update Date2025-03-24 22:30:39 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01221665
Frequency1.1
Structure
Chemical FormulaC5H11NO2
Molecular Mass117.079
SMILESCC(O)C(N)CC=O
InChI KeyPSGGRSUHKQPSBO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent alpha-hydrogen aldehydes
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary alcohols
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • organic oxide
  • alpha-hydrogen aldehyde
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound