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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:02:36 UTC
Update Date2025-03-25 00:54:34 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02207181
Frequency0.5
Structure
Chemical FormulaC11H17N6O8P
Molecular Mass392.0845
SMILESNc1nc(N)c2ncn(CC(O)C(O)C(O)COP(=O)(O)O)c2c(=O)n1
InChI KeyUTZORSXWLZCOJM-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
  • imidolactams
  • monoalkyl phosphates
  • n-substituted imidazoles
  • organic oxides
  • organopnictogen compounds
  • primary amines
  • secondary alcohols
    • Substituents
  • imidazo-meta-diazepine
  • organic oxide
  • aromatic heteropolycyclic compound
  • imidazole
  • organonitrogen compound
  • organopnictogen compound
  • imidolactam
  • azole
  • n-substituted imidazole
  • meta-diazepine
  • alcohol
  • azacycle
  • heteroaromatic compound
  • organic oxygen compound
  • phosphoric acid ester
  • monoalkyl phosphate
  • secondary alcohol
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • organic phosphoric acid derivative
  • amine
  • alkyl phosphate
  • organooxygen compound