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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:38:22 UTC
Update Date2025-03-25 00:45:53 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02151978
Frequency0.5
Structure
Chemical FormulaC10H11N3O7
Molecular Mass285.0597
SMILESNC(=O)c1cn(C2CC(O)C(C(=O)O)O2)c(=O)[nH]c1=O
InChI KeyKFMNZZDJXOMNNZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazines
Subclass pyrimidines and pyrimidine derivatives
Direct Parent pyrimidinecarboxylic acids and derivatives
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • beta hydroxy acids and derivatives
  • carbonyl compounds
  • carboxylic acids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • lactams
  • monocarboxylic acids and derivatives
  • monosaccharides
  • organic carbonic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • primary carboxylic acid amides
  • pyrimidones
  • secondary alcohols
  • tetrahydrofurans
  • vinylogous amides
  • Substituents
  • primary carboxylic acid amide
  • carbonyl group
  • lactam
  • carboxylic acid
  • aromatic heteromonocyclic compound
  • monosaccharide
  • pyrimidone
  • carboxylic acid derivative
  • beta-hydroxy acid
  • saccharide
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • alcohol
  • vinylogous amide
  • carbonic acid derivative
  • azacycle
  • tetrahydrofuran
  • heteroaromatic compound
  • pyrimidine-5-carboxylic acid or derivatives
  • hydroxy acid
  • carboxamide group
  • oxacycle
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound