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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:39:49 UTC
Update Date2025-03-25 00:46:28 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02155408
Frequency0.5
Structure
Chemical FormulaC9H15N4O4+
Molecular Mass243.1088
SMILESCc1nc[n+](C2OC(CO)C(O)C2O)c(N)n1
InChI KeyFSUZRJUJWLAYKQ-UHFFFAOYSA-O
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classtriazines
Subclass aminotriazines
Direct Parent aminotriazines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • halo-s-triazines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monosaccharides
  • organic cations
  • organopnictogen compounds
  • oxacyclic compounds
  • primary alcohols
  • primary amines
  • secondary alcohols
  • tetrahydrofurans
  • Substituents
  • amino-1,3,5-triazine
  • aromatic heteromonocyclic compound
  • monosaccharide
  • saccharide
  • organonitrogen compound
  • organopnictogen compound
  • organic cation
  • primary alcohol
  • alcohol
  • azacycle
  • tetrahydrofuran
  • aminotriazine
  • heteroaromatic compound
  • oxacycle
  • organic oxygen compound
  • halo-s-triazine
  • secondary alcohol
  • hydrocarbon derivative
  • 1,3,5-triazine
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound