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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:11:04 UTC
Update Date2025-03-21 23:09:55 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00653399
Frequency2.4
Structure
Chemical FormulaC6H11N3O
Molecular Mass141.0902
SMILESCn1cc(CN)n(C)c1=O
InChI KeyNVWQSOOTPHLCFN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazoles
Subclass imidazoles
Direct Parent n-substituted imidazoles
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • ureas
    • Substituents
  • carbonic acid derivative
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • urea
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound
  • n-substituted imidazole