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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:07:34 UTC
Update Date2025-03-25 00:56:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02218817
Frequency0.5
Structure
Chemical FormulaC5H9N5O3S
Molecular Mass219.0426
SMILESCn1c(N)c(S(N)(=O)=O)c(N)nc1=O
InChI KeyHLWXWPOMHMPMID-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazines
Subclass pyrimidines and pyrimidine derivatives
Direct Parent pyrimidones
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aminosulfonyl compounds
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidolactams
  • organic carbonic acids and derivatives
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • organosulfonamides
  • primary amines
  • Substituents
  • organosulfonic acid or derivatives
  • carbonic acid derivative
  • aromatic heteromonocyclic compound
  • azacycle
  • aminosulfonyl compound
  • heteroaromatic compound
  • pyrimidone
  • organosulfur compound
  • organosulfonic acid amide
  • organic oxide
  • sulfonyl
  • organic oxygen compound
  • organic sulfonic acid or derivatives
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • imidolactam
  • amine
  • organooxygen compound