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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:31:46 UTC
Update Date2025-03-21 18:42:11 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00138130
Frequency32.5
Structure
Chemical FormulaC9H14N3O6+
Molecular Mass260.0877
SMILESCn1c[n+](C2OC(CO)C(O)C2O)c(=O)[nH]c1=O
InChI KeyXFGGYNBQRNPVOQ-UHFFFAOYSA-O
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classtriazines
Subclass triazinones
Direct Parent triazinones
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 1,3,5-triazines
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monosaccharides
  • organic carbonic acids and derivatives
  • organic cations
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • primary alcohols
  • secondary alcohols
  • tetrahydrofurans
  • Substituents
  • alcohol
  • carbonic acid derivative
  • aromatic heteromonocyclic compound
  • azacycle
  • tetrahydrofuran
  • heteroaromatic compound
  • monosaccharide
  • oxacycle
  • saccharide
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • 1,3,5-triazine
  • organic nitrogen compound
  • organic cation
  • primary alcohol
  • triazinone
  • organooxygen compound