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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:37:56 UTC
Update Date2025-03-25 00:45:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02150996
Frequency0.5
Structure
Chemical FormulaC12H16N2O7
Molecular Mass300.0958
SMILESCC(C(=O)O)n1c(=O)ccn(C2CC(O)C(CO)O2)c1=O
InChI KeyLETJUNZUCOSHTN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassnucleosides, nucleotides, and analogues
Classpyrimidine nucleosides
Subclass pyrimidine nucleosides
Direct Parent pyrimidine nucleosides
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • alpha amino acids and derivatives
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • lactams
  • monocarboxylic acids and derivatives
  • monosaccharides
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • primary alcohols
  • pyrimidones
  • secondary alcohols
  • tetrahydrofurans
  • ureas
  • vinylogous amides
  • Substituents
  • carbonyl group
  • lactam
  • carboxylic acid
  • aromatic heteromonocyclic compound
  • monosaccharide
  • pyrimidone
  • alpha-amino acid or derivatives
  • carboxylic acid derivative
  • pyrimidine
  • urea
  • saccharide
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • pyrimidine nucleoside
  • primary alcohol
  • organoheterocyclic compound
  • alcohol
  • vinylogous amide
  • carbonic acid derivative
  • azacycle
  • tetrahydrofuran
  • heteroaromatic compound
  • oxacycle
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound