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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:21:47 UTC
Update Date2025-03-25 01:01:43 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02251214
Frequency0.5
Structure
Chemical FormulaC16H21N5O9
Molecular Mass427.1339
SMILESO=c1ncnc2c(ncn2C2OC(CO)C(O)C2O)c1NC1OC(CO)C(O)C1O
InChI KeyKBCYRSUSZAHCAT-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
  • monosaccharides
  • n-substituted imidazoles
  • organic oxides
  • organopnictogen compounds
  • oxacyclic compounds
  • primary alcohols
  • secondary alcohols
  • secondary alkylarylamines
  • tetrahydrofurans
    • Substituents
  • monosaccharide
  • imidazo-meta-diazepine
  • imidazodiazepine
  • saccharide
  • organic oxide
  • aromatic heteropolycyclic compound
  • imidazole
  • organonitrogen compound
  • organopnictogen compound
  • primary alcohol
  • azole
  • n-substituted imidazole
  • meta-diazepine
  • alcohol
  • azacycle
  • tetrahydrofuran
  • heteroaromatic compound
  • secondary amine
  • secondary aliphatic/aromatic amine
  • oxacycle
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine