Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:34:07 UTC
Update Date2025-03-21 17:56:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00001740
Frequency3555.7
Structure
Chemical FormulaC6H8N4O3
Molecular Mass184.0596
SMILESCC(=O)Nc1c(N)[nH]c(=O)[nH]c1=O
InChI KeyRJTOYKGWZKBHLX-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
  • amino acids and derivatives
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • lactams
  • organic carbonic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • primary amines
  • pyrimidones
  • secondary carboxylic acid amides
  • vinylogous amides
  • Substituents
  • carbonyl group
  • lactam
  • n-acetylarylamine
  • aromatic heteromonocyclic compound
  • amino acid or derivatives
  • pyrimidone
  • carboxylic acid derivative
  • pyrimidine
  • organic oxide
  • organopnictogen compound
  • organoheterocyclic compound
  • acetamide
  • vinylogous amide
  • carbonic acid derivative
  • azacycle
  • heteroaromatic compound
  • carboxamide group
  • secondary carboxylic acid amide
  • organic oxygen compound
  • hydrocarbon derivative
  • primary amine
  • amine
  • organooxygen compound