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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:43:17 UTC
Update Date2025-03-21 20:01:33 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00304024
Frequency6.5
Structure
Chemical FormulaC5H8N2S
Molecular Mass128.0408
SMILESS=C=NC1CCCN1
InChI KeyNZMZJUJQGHRFLT-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
  • isothiocyanates
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • secondary aliphatic amine
  • isothiocyanate
  • azacycle
  • organic 1,3-dipolar compound
  • secondary amine
  • organosulfur compound
  • propargyl-type 1,3-dipolar organic compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • pyrrolidine
  • amine