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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 16:45:04 UTC
Update Date2025-03-25 01:33:36 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02444134
Frequency0.5
Structure
Chemical FormulaC6H11N3O
Molecular Mass141.0902
SMILESCCC1=NC(CN)NC1=O
InChI KeyWWUNBCNXBVZGNW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazolines
Subclass imidazolines
Direct Parent imidazolinones
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • ketimines
  • lactams
  • monoalkylamines
  • organic oxides
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • secondary carboxylic acid amides
    • Substituents
  • ketimine
  • carbonyl group
  • lactam
  • azacycle
  • imine
  • organic 1,3-dipolar compound
  • carboxamide group
  • carboxylic acid derivative
  • propargyl-type 1,3-dipolar organic compound
  • secondary carboxylic acid amide
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • imidazolinone
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound