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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:00:08 UTC
Update Date2025-03-25 00:53:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02201586
Frequency0.5
Structure
Chemical FormulaC13H20N4O5
Molecular Mass312.1434
SMILESCc1c(C)n(CC(O)C(O)C(O)CO)c2nc(N)[nH]c(=O)c12
InChI KeyJSODQODOTCOOKO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolopyrimidines
Subclass pyrrolo[2,3-d]pyrimidines
Direct Parent pyrrolo[2,3-d]pyrimidines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • lactams
  • organic oxides
  • organopnictogen compounds
  • primary alcohols
  • primary amines
  • pyrimidones
  • secondary alcohols
  • substituted pyrroles
  • vinylogous amides
  • Substituents
  • lactam
  • pyrimidone
  • substituted pyrrole
  • pyrimidine
  • organic oxide
  • pyrrolo[2,3-d]pyrimidine
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • primary alcohol
  • alcohol
  • vinylogous amide
  • azacycle
  • heteroaromatic compound
  • organic oxygen compound
  • pyrrole
  • secondary alcohol
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound