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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:18:49 UTC
Update Date2025-03-21 18:35:50 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00107475
Frequency40.0
Structure
Chemical FormulaC6H7N5O2
Molecular Mass181.06
SMILESNc1nc(=O)c2c([nH]1)NC(=O)CN2
InChI KeyJOCAZCZIQTXMHW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpteridines and derivatives
Subclass pterins and derivatives
Direct Parent pterins and derivatives
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alpha amino acids
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • lactams
  • organic oxides
  • organopnictogen compounds
  • primary amines
  • pyrimidones
  • secondary alkylarylamines
  • secondary carboxylic acid amides
  • vinylogous amides
  • Substituents
  • carbonyl group
  • lactam
  • amino acid or derivatives
  • pyrimidone
  • alpha-amino acid or derivatives
  • carboxylic acid derivative
  • pyrimidine
  • organic oxide
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • vinylogous amide
  • pterin
  • azacycle
  • heteroaromatic compound
  • secondary amine
  • carboxamide group
  • secondary aliphatic/aromatic amine
  • secondary carboxylic acid amide
  • organic oxygen compound
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound