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Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:49:17 UTC
Update Date2025-03-21 18:02:11 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00036839
Frequency95.8
Structure
Chemical FormulaC8H12N4O4
Molecular Mass228.0859
SMILESCC1OC(n2cnc(N)nc2=O)C(O)C1O
InChI KeyJMHSZDNWWSJKLU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classtriazines
Subclass aminotriazines
Direct Parent aminotriazines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 1,2-diols
  • azacyclic compounds
  • halo-s-triazines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monosaccharides
  • organic carbonic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • oxacyclic compounds
  • primary amines
  • secondary alcohols
  • tetrahydrofurans
  • triazinones
    • Substituents
  • amino-1,3,5-triazine
  • aromatic heteromonocyclic compound
  • monosaccharide
  • saccharide
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • 1,2-diol
  • alcohol
  • carbonic acid derivative
  • 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
  • triazinone
  • organooxygen compound