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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:43:54 UTC
Update Date2025-03-25 00:47:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02164478
Frequency0.5
Structure
Chemical FormulaC10H11N5O3
Molecular Mass249.0862
SMILESCC(O)(Cc1cnc2ncnc(N)c2n1)C(=O)O
InChI KeyBCZVYUAZNUDNOJ-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 hydroxy acids and derivatives
  • amino acids
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidolactams
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • primary amines
  • pyrazines
  • pyrimidines and pyrimidine derivatives
  • tertiary alcohols
  • Substituents
  • carbonyl group
  • carboxylic acid
  • amino acid or derivatives
  • amino acid
  • alpha-hydroxy acid
  • pteridine
  • carboxylic acid derivative
  • pyrimidine
  • organic oxide
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • imidolactam
  • alcohol
  • azacycle
  • heteroaromatic compound
  • hydroxy acid
  • tertiary alcohol
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • pyrazine
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound