Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:11:08 UTC
Update Date2025-03-21 22:11:41 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00511535
Frequency3.3
Structure
Chemical FormulaC7H13NO2
Molecular Mass143.0946
SMILESCCCC(=O)C(N)C(C)=O
InChI KeyHERLIMYSPPUDPK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent beta-diketones
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • ketones
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • ketone
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • 1,3-diketone