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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:14:07 UTC
Update Date2025-03-25 00:58:54 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02233541
Frequency0.5
Structure
Chemical FormulaC5H4N2O3S
Molecular Mass171.9943
SMILESNc1nc(C(=O)O)c(C=O)s1
InChI KeyPJMSMGOSAHIHKF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazoles
Subclass thiazoles
Direct Parent thiazolecarboxylic acids and derivatives
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 2,4,5-trisubstituted thiazoles
  • amino acids
  • aryl-aldehydes
  • azacyclic compounds
  • carboxylic acids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • primary amines
  • Substituents
  • carboxylic acid
  • aromatic heteromonocyclic compound
  • amino acid or derivatives
  • amino acid
  • carboxylic acid derivative
  • thiazolecarboxylic acid or derivatives
  • 2,4,5-trisubstituted 1,3-thiazole
  • organic oxide
  • aryl-aldehyde
  • organonitrogen compound
  • organopnictogen compound
  • azacycle
  • heteroaromatic compound
  • aldehyde
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound