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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:01:12 UTC
Update Date2025-03-25 00:54:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02203977
Frequency0.5
Structure
Chemical FormulaC12H20N4O9
Molecular Mass364.123
SMILESO=c1nc(NCC(O)C(O)CO)[nH]c(=O)n1C1OC(CO)C(O)C1O
InChI KeyDRVCLPKRUPUART-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classtriazines
Subclass aminotriazines
Direct Parent n-aliphatic s-triazines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • halo-s-triazines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monosaccharides
  • organic carbonic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • oxacyclic compounds
  • primary alcohols
  • secondary alcohols
  • secondary alkylarylamines
  • tetrahydrofurans
  • triazinones
    • Substituents
  • n-aliphatic s-triazine
  • aromatic heteromonocyclic compound
  • monosaccharide
  • saccharide
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • primary alcohol
  • alcohol
  • carbonic acid derivative
  • azacycle
  • tetrahydrofuran
  • heteroaromatic compound
  • secondary amine
  • secondary aliphatic/aromatic amine
  • oxacycle
  • organic oxygen compound
  • halo-s-triazine
  • secondary alcohol
  • hydrocarbon derivative
  • 1,3,5-triazine
  • organic nitrogen compound
  • triazinone
  • organooxygen compound
  • amine