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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:19:57 UTC
Update Date2025-03-21 19:11:34 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00250742
Frequency8.4
Structure
Chemical FormulaC5H9N3
Molecular Mass111.0796
SMILESCC1=NCN=C(C)N1
InChI KeyUIMWBWAYRWFBJF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classtriazines
Subclass 1,3,5-triazines
Direct Parent 1,3,5-triazines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • amidines
  • azacyclic compounds
  • carboximidamides
  • hydrocarbon derivatives
  • imidolactams
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • azacycle
  • organic 1,3-dipolar compound
  • amidine
  • carboximidamide
  • propargyl-type 1,3-dipolar organic compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • 1,3,5-triazine
  • organic nitrogen compound
  • imidolactam