Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:25:14 UTC
Update Date2025-03-25 01:02:57 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02258969
Frequency0.5
Structure
Chemical FormulaC6H11NO3
Molecular Mass145.0739
SMILESCCCC(=O)CC(O)=NO
InChI KeyMOAWDAQUTQBNMW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent beta-hydroxy ketones
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • beta-hydroxy ketone
  • aliphatic acyclic compound
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound