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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:13:01 UTC
Update Date2025-03-25 00:58:29 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02231040
Frequency0.5
Structure
Chemical FormulaC11H18N4O3
Molecular Mass254.1379
SMILESCCN(CC)c1c(NC(C)=O)c(=O)[nH]c(=O)n1C
InChI KeyDZCQEKFUTAWGDQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass n-arylamides
Direct Parent n-acetylarylamines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • acetamides
  • aminopyrimidines and derivatives
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • dialkylarylamines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • lactams
  • organic carbonic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • pyrimidones
  • secondary carboxylic acid amides
  • vinylogous amides
    • Substituents
  • carbonyl group
  • lactam
  • n-acetylarylamine
  • aromatic heteromonocyclic compound
  • pyrimidone
  • carboxylic acid derivative
  • pyrimidine
  • organic oxide
  • organopnictogen compound
  • dialkylarylamine
  • organoheterocyclic compound
  • acetamide
  • vinylogous amide
  • carbonic acid derivative
  • azacycle
  • heteroaromatic compound
  • carboxamide group
  • aminopyrimidine
  • secondary carboxylic acid amide
  • organic oxygen compound
  • hydrocarbon derivative
  • organooxygen compound