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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 09:49:07 UTC
Update Date2025-03-24 20:29:21 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01463421
Frequency0.9
Structure
Chemical FormulaC5H7N3O
Molecular Mass125.0589
SMILESCC(=O)C1=NC(=N)NC1
InChI KeyBKVUXDABKDRFSY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazolines
Subclass imidazolines
Direct Parent imidazolines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carboximidamides
  • hydrocarbon derivatives
  • imines
  • ketones
  • organic oxides
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • carbonyl group
  • azacycle
  • imine
  • organic 1,3-dipolar compound
  • carboximidamide
  • propargyl-type 1,3-dipolar organic compound
  • ketone
  • organic oxide
  • organic oxygen compound
  • imidazoline
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • 3-imidazoline
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound