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Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:48:37 UTC
Update Date2025-03-21 18:01:53 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00035222
Frequency101.4
Structure
Chemical FormulaC8H12N4O5
Molecular Mass244.0808
SMILESNc1cnn(C2OC(CO)C(O)C2O)c(=O)n1
InChI KeyOZQDLJNDRVBCST-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classtriazines
Subclass 1,2,4-triazines
Direct Parent 1,2,4-triazines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidolactams
  • monosaccharides
  • organic carbonic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • oxacyclic compounds
  • primary alcohols
  • primary amines
  • secondary alcohols
  • tetrahydrofurans
    • Substituents
  • aromatic heteromonocyclic compound
  • monosaccharide
  • saccharide
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • primary alcohol
  • imidolactam
  • alcohol
  • carbonic acid derivative
  • azacycle
  • tetrahydrofuran
  • heteroaromatic compound
  • oxacycle
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • 1,2,4-triazine
  • amine
  • organooxygen compound