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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:22:11 UTC
Update Date2025-03-21 18:37:25 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00115639
Frequency22.8
Structure
Chemical FormulaC8H8N4O3
Molecular Mass208.0596
SMILESCn1cnc2c1c(=O)c(=O)[nH]c(=O)n2C
InChI KeyYWFSDKLOIXZSFI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classimidazodiazepines
Subclass imidazodiazepines
Direct Parent imidazodiazepines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1,3-diazepines
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • lactams
  • n-substituted imidazoles
  • organic carbonic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • vinylogous amides
    • Substituents
  • meta-diazepine
  • vinylogous amide
  • carbonic acid derivative
  • lactam
  • azacycle
  • heteroaromatic compound
  • imidazo-meta-diazepine
  • imidazodiazepine
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • imidazole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • azole
  • n-substituted imidazole