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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 08:28:14 UTC
Update Date2025-03-25 00:18:15 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01272132
Frequency1.0
Structure
Chemical FormulaC4H7N3
Molecular Mass97.064
SMILESNC1=NCC=CN1
InChI KeyLJAQCGVQGABMRK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass guanidines
Direct Parent guanidines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carboximidamides
  • hydrocarbon derivatives
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • azacycle
  • guanidine
  • aliphatic heteromonocyclic compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic 1,3-dipolar compound
  • carboximidamide
  • organoheterocyclic compound
  • propargyl-type 1,3-dipolar organic compound