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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:48:43 UTC
Update Date2025-03-25 00:49:37 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02175536
Frequency0.5
Structure
Chemical FormulaC12H9N3O
Molecular Mass211.0746
SMILESNc1ncnc2oc(-c3ccccc3)cc12
InChI KeyKLUPXPVKDBPOMJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classfuro[2,3-d]pyrimidines
Subclass furo[2,3-d]pyrimidines
Direct Parent furo[2,3-d]pyrimidines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • benzene and substituted derivatives
  • furans
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidolactams
  • organooxygen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • primary amines
  • pyrimidines and pyrimidine derivatives
  • Substituents
  • furo[2,3-d]pyrimidine
  • furan
  • monocyclic benzene moiety
  • azacycle
  • heteroaromatic compound
  • pyrimidine
  • oxacycle
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • primary amine
  • organic nitrogen compound
  • imidolactam
  • amine
  • organooxygen compound