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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 17:10:30 UTC
Update Date2025-03-25 01:44:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02503658
Frequency0.5
Structure
Chemical FormulaC7H11NO
Molecular Mass125.0841
SMILESC=CC1C(O)=NC1(C)C
InChI KeyBDJRMHAERAIJPB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboximidic acids and derivatives
Subclass carboximidic acids
Direct Parent cyclic carboximidic acids
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • hydrocarbon derivatives
  • lactims
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • azacycle
  • organic 1,3-dipolar compound
  • propargyl-type 1,3-dipolar organic compound
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • lactim
  • cyclic carboximidic acid
  • organoheterocyclic compound
  • organooxygen compound