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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:16:29 UTC
Update Date2025-03-25 00:59:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02238941
Frequency0.5
Structure
Chemical FormulaC12H16N6O2
Molecular Mass276.1335
SMILESN=c1[nH]c2[nH]cc(CNC3C=CC(O)C3O)c2nc1N
InChI KeyNSNWOEGWVVUDLP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolopyrazines
Subclass pyrrolopyrazines
Direct Parent pyrrolopyrazines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1,2-diols
  • azacyclic compounds
  • dialkylamines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidolactams
  • organopnictogen compounds
  • primary amines
  • pyrazines
  • pyrroles
  • secondary alcohols
  • Substituents
  • alcohol
  • secondary aliphatic amine
  • azacycle
  • heteroaromatic compound
  • secondary amine
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyrazine
  • pyrrole
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • imidolactam
  • amine
  • pyrrolopyrazine
  • organooxygen compound
  • 1,2-diol