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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:37:39 UTC
Update Date2025-03-21 19:59:26 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00291301
Frequency6.9
Structure
Chemical FormulaC4H7N3O
Molecular Mass113.0589
SMILESCc1[nH]c(=O)[nH]c1N
InChI KeySNSOBNUNVOMCPB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazoles
Subclass imidazoles
Direct Parent imidazoles
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic carbonic acids and derivatives
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • primary amines
    • Substituents
  • carbonic acid derivative
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • organic oxide
  • organic oxygen compound
  • imidazole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound