Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:38:39 UTC
Update Date2025-03-24 13:59:57 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00719400
Frequency2.1
Structure
Chemical FormulaC5H9NO3
Molecular Mass131.0582
SMILESCC(=O)CCC(O)=NO
InChI KeyBBBJZDFCWMSCLS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent ketones
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • ketone
  • aliphatic acyclic compound
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound