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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 11:32:01 UTC
Update Date2025-03-24 21:13:31 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01710872
Frequency0.7
Structure
Chemical FormulaC5H9NO
Molecular Mass99.0684
SMILESOCC1C=CCN1
InChI KeyKCJCTHAQPCGMBB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolines
Subclass pyrrolines
Direct Parent pyrrolines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • dialkylamines
  • hydrocarbon derivatives
  • organopnictogen compounds
  • primary alcohols
    • Substituents
  • alcohol
  • secondary aliphatic amine
  • azacycle
  • secondary amine
  • organic oxygen compound
  • pyrroline
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • primary alcohol
  • organooxygen compound
  • amine