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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:10:19 UTC
Update Date2025-03-25 00:57:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02225134
Frequency0.5
Structure
Chemical FormulaC8H11N3O6
Molecular Mass245.0648
SMILESNc1nc(=O)n(C2CC(O)C(CO)O2)c(=O)o1
InChI KeyPMZRJYQVLGZESI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbohydrates and carbohydrate conjugates
Direct Parent monosaccharides
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic carbonic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • oxacyclic compounds
  • primary alcohols
  • primary amines
  • secondary alcohols
  • tetrahydrofurans
  • Substituents
  • alcohol
  • carbonic acid derivative
  • aromatic heteromonocyclic compound
  • azacycle
  • tetrahydrofuran
  • heteroaromatic compound
  • monosaccharide
  • oxacycle
  • organic oxide
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • primary alcohol
  • amine
  • organoheterocyclic compound