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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:49:03 UTC
Update Date2025-03-25 00:49:45 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02176331
Frequency0.5
Structure
Chemical FormulaC8H10N4O4
Molecular Mass226.0702
SMILESCC(O)C(O)c1cnc2c(=O)[nH]c(=O)[nH]n12
InChI KeyWESQACIPCWGJGS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classtriazines
Subclass 1,2,4-triazines
Direct Parent 1,2,4-triazines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1,2-diols
  • aromatic alcohols
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • lactams
  • n-substituted imidazoles
  • organic carbonic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary alcohols
    • Substituents
  • aromatic alcohol
  • alcohol
  • carbonic acid derivative
  • lactam
  • azacycle
  • heteroaromatic compound
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • imidazole
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • 1,2,4-triazine
  • organooxygen compound
  • azole
  • 1,2-diol
  • n-substituted imidazole