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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:06:47 UTC
Update Date2025-03-25 00:56:14 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02216993
Frequency0.5
Structure
Chemical FormulaC7H11N3O4
Molecular Mass201.075
SMILESO=c1cnn(C2CC(O)C(CO)O2)[nH]1
InChI KeyNZQQDJXCKMRTLQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbohydrates and carbohydrate conjugates
Direct Parent monosaccharides
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • lactams
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • primary alcohols
  • secondary alcohols
  • tetrahydrofurans
  • triazolones
  • Substituents
  • triazole
  • lactam
  • aromatic heteromonocyclic compound
  • monosaccharide
  • 1,2,3-triazolone
  • organic oxide
  • triazolone
  • organonitrogen compound
  • organopnictogen compound
  • primary alcohol
  • 1,2,3-triazole
  • organoheterocyclic compound
  • azole
  • alcohol
  • azacycle
  • tetrahydrofuran
  • heteroaromatic compound
  • oxacycle
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound