Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:53:41 UTC
Update Date2025-03-25 00:51:25 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02186918
Frequency0.5
Structure
Chemical FormulaC9H8N2O4S
Molecular Mass240.0205
SMILESNS(=O)(=O)c1cc(O)cc2[nH]c(=O)ccc12
InChI KeyCVLIHJILALWAJK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classquinolines and derivatives
Subclass quinolones and derivatives
Direct Parent hydroquinolones
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 2-halopyridines
  • aminosulfonyl compounds
  • azacyclic compounds
  • benzenoids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroquinolines
  • hydroxypyridines
  • lactams
  • organic oxides
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • organosulfonamides
  • polyhalopyridines
  • pyridinones
  • Substituents
  • organosulfonic acid or derivatives
  • lactam
  • polyhalopyridine
  • 1-hydroxy-2-unsubstituted benzenoid
  • organosulfur compound
  • organosulfonic acid amide
  • organic oxide
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • 2-halopyridine
  • azacycle
  • aminosulfonyl compound
  • heteroaromatic compound
  • hydroxypyridine
  • dihydroquinoline
  • dihydroquinolone
  • sulfonyl
  • pyridine
  • organic oxygen compound
  • organic sulfonic acid or derivatives
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • pyridinone
  • organooxygen compound