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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:39:39 UTC
Update Date2025-03-25 00:46:24 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02155041
Frequency0.5
Structure
Chemical FormulaC14H28N2O2
Molecular Mass256.2151
SMILESCC(=O)C(CCC(C)C)N=C(O)C(N)CC(C)C
InChI KeyBLHRJRYRZIQXSA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent ketones
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carboximidic acids
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • aliphatic acyclic compound
  • carboximidic acid
  • organic 1,3-dipolar compound
  • propargyl-type 1,3-dipolar organic compound
  • ketone
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound