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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:42:37 UTC
Update Date2025-03-25 00:47:24 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02161555
Frequency0.5
Structure
Chemical FormulaC10H13N5O
Molecular Mass219.112
SMILESC=CC1CN2c3c(nc(N)[nH]c3=O)NCC12
InChI KeyAGQUAOCQFGNEAT-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
  • azacyclic compounds
  • azetidines
  • dialkylarylamines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidolactams
  • lactams
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • primary amines
  • pyrimidones
  • secondary alkylarylamines
  • vinylogous amides
  • Substituents
  • lactam
  • pyrimidone
  • pyrimidine
  • organic oxide
  • aromatic heteropolycyclic compound
  • tertiary aliphatic/aromatic amine
  • organonitrogen compound
  • organopnictogen compound
  • dialkylarylamine
  • imidolactam
  • tertiary amine
  • vinylogous amide
  • pterin
  • azacycle
  • heteroaromatic compound
  • secondary amine
  • secondary aliphatic/aromatic amine
  • azetidine
  • organic oxygen compound
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound