Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:49:00 UTC
Update Date2025-03-21 18:02:03 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00036145
Frequency98.1
Structure
Chemical FormulaC5H6N2O3S
Molecular Mass174.0099
SMILESNS(=O)(=O)Oc1cccnc1
InChI KeyJDVVPRKRSOHXQI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass pyridines and derivatives
Direct Parent pyridines and derivatives
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic oxides
  • organic sulfuric acids and derivatives
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • Substituents
  • organic sulfuric acid or derivatives
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • organic oxide
  • pyridine
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound