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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:04:14 UTC
Update Date2025-03-21 22:08:20 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00495350
Frequency3.5
Structure
Chemical FormulaC4H7NO2
Molecular Mass101.0477
SMILESOC(O)=NC1CC1
InChI KeyZHFRJPQWBUSQDU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic 1,3-dipolar compounds
Classpropargyl-type 1,3-dipolar organic compounds
Subclass propargyl-type 1,3-dipolar organic compounds
Direct Parent propargyl-type 1,3-dipolar organic compounds
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
    • Substituents
  • organic oxygen compound
  • organonitrogen compound
  • aliphatic homomonocyclic compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • propargyl-type 1,3-dipolar organic compound