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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:15:40 UTC
Update Date2025-03-25 00:59:26 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02237106
Frequency0.5
Structure
Chemical FormulaC9H10N6O3
Molecular Mass250.0814
SMILESNc1ncnc2nc(C(O)C(N)C(=O)O)cnc12
InChI KeyUYVIIGJCOAHRAM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpteridines and derivatives
Subclass pteridines and derivatives
Direct Parent pteridines and derivatives
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alpha amino acids
  • amino acids
  • aromatic alcohols
  • azacyclic compounds
  • beta hydroxy acids and derivatives
  • carbonyl compounds
  • carboxylic acids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidolactams
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • pyrazines
  • pyrimidines and pyrimidine derivatives
  • secondary alcohols
  • Substituents
  • aromatic alcohol
  • carbonyl group
  • carboxylic acid
  • amino acid or derivatives
  • amino acid
  • alpha-amino acid or derivatives
  • pteridine
  • carboxylic acid derivative
  • pyrimidine
  • beta-hydroxy acid
  • organic oxide
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • imidolactam
  • alcohol
  • azacycle
  • heteroaromatic compound
  • hydroxy acid
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • pyrazine
  • secondary alcohol
  • hydrocarbon derivative
  • primary aliphatic amine
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound