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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:09:26 UTC
Update Date2025-03-21 18:31:12 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00084768
Frequency65.3
Structure
Chemical FormulaC11H15N3O
Molecular Mass205.1215
SMILESCCC1=C(C)C(Cc2cnc[nH]2)NC1=O
InChI KeyFWVFMXMJAKKTOK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazoles
Subclass imidazoles
Direct Parent imidazoles
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • lactams
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrrolines
  • secondary carboxylic acid amides
    • Substituents
  • carbonyl group
  • lactam
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • carboxamide group
  • carboxylic acid derivative
  • secondary carboxylic acid amide
  • organic oxide
  • organic oxygen compound
  • pyrroline
  • imidazole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound