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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:44:50 UTC
Update Date2025-03-25 00:48:12 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02166702
Frequency0.5
Structure
Chemical FormulaC11H17N3O8P+
Molecular Mass350.0748
SMILESCC(=O)Nc1cc[n+](C2OC(COP(=O)(O)O)C(O)C2O)cn1
InChI KeyCVOKEHSLINFPDG-UHFFFAOYSA-O
Chemical Taxonomy
Kingdomorganic compounds
Superclassnucleosides, nucleotides, and analogues
Classpyrimidine nucleotides
Subclass pyrimidine ribonucleotides
Direct Parent pyrimidine ribonucleoside monophosphates
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 1,2-diols
  • acetamides
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidolactams
  • monoalkyl phosphates
  • monosaccharides
  • n-acetylarylamines
  • organic cations
  • organic oxides
  • organopnictogen compounds
  • oxacyclic compounds
  • pentose phosphates
  • pyrimidines and pyrimidine derivatives
  • secondary alcohols
  • secondary carboxylic acid amides
  • tetrahydrofurans
  • Substituents
  • carbonyl group
  • n-acetylarylamine
  • aromatic heteromonocyclic compound
  • pentose phosphate
  • monosaccharide
  • pentose-5-phosphate
  • n-arylamide
  • carboxylic acid derivative
  • pyrimidine
  • saccharide
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • organic cation
  • imidolactam
  • organoheterocyclic compound
  • acetamide
  • 1,2-diol
  • alcohol
  • azacycle
  • tetrahydrofuran
  • heteroaromatic compound
  • carboxamide group
  • oxacycle
  • secondary carboxylic acid amide
  • pyrimidine ribonucleoside monophosphate
  • organic oxygen compound
  • phosphoric acid ester
  • monoalkyl phosphate
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic phosphoric acid derivative
  • alkyl phosphate
  • organooxygen compound