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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:15:48 UTC
Update Date2025-03-21 18:34:16 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00100011
Frequency27.4
Structure
Chemical FormulaC5H12N2O
Molecular Mass116.095
SMILESNCC1CC(O)CN1
InChI KeyVPKJBJVGUAQJOS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolidines
Subclass pyrrolidines
Direct Parent pyrrolidines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • dialkylamines
  • hydrocarbon derivatives
  • monoalkylamines
  • organopnictogen compounds
  • secondary alcohols
    • Substituents
  • alcohol
  • secondary aliphatic amine
  • azacycle
  • secondary amine
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • pyrrolidine
  • organooxygen compound
  • amine