Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 09:53:53 UTC
Update Date2025-03-24 20:31:22 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01474997
Frequency0.9
Structure
Chemical FormulaC4H9NO3
Molecular Mass119.0582
SMILESCC(N)COC(=O)O
InChI KeyZXJYHNVANRRSFE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classorganic carbonic acids and derivatives
Subclass carbonic acid monoesters
Direct Parent carbonic acid monoesters
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • organic oxide
  • carbonic acid monoester
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound