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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:37:06 UTC
Update Date2025-03-25 00:45:25 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02149018
Frequency0.5
Structure
Chemical FormulaC10H17NO2
Molecular Mass183.1259
SMILESCCCC=CC(=O)C(=O)CCCN
InChI KeyJOCPPVQFDMCTHM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent alpha-diketones
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • acryloyl compounds
  • enones
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
    • Substituents
  • aliphatic acyclic compound
  • alpha,beta-unsaturated ketone
  • alpha-diketone
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • acryloyl-group
  • primary aliphatic amine
  • organic nitrogen compound
  • enone