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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:54:32 UTC
Update Date2025-03-25 00:51:42 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02188839
Frequency0.5
Structure
Chemical FormulaC10H12N4O4
Molecular Mass252.0859
SMILESCC(O)C(O)C(=O)C1CN=c2[nH]cnc(=O)c2=N1
InChI KeyLMLGYVMRXCFETM-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
  • 1,2-diols
  • acyloins
  • azacyclic compounds
  • beta-hydroxy ketones
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidolactams
  • monosaccharides
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrimidones
  • secondary alcohols
  • vinylogous amides
  • Substituents
  • beta-hydroxy ketone
  • carbonyl group
  • monosaccharide
  • pyrimidone
  • pteridine
  • pyrimidine
  • ketone
  • saccharide
  • organic oxide
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • imidolactam
  • 1,2-diol
  • alcohol
  • vinylogous amide
  • azacycle
  • heteroaromatic compound
  • organic oxygen compound
  • acyloin
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound