Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:56:46 UTC
Update Date2025-03-21 18:05:03 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00054504
Frequency59.0
Structure
Chemical FormulaC5H13NO3
Molecular Mass135.0895
SMILESOCCNCC(O)CO
InChI KeyWDMIBBXCJKNKPN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent secondary alcohols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkanolamines
  • dialkylamines
  • hydrocarbon derivatives
  • organopnictogen compounds
  • primary alcohols
  • Substituents
  • aliphatic acyclic compound
  • secondary aliphatic amine
  • secondary amine
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • primary alcohol
  • amine
  • alkanolamine