Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:33:47 UTC
Update Date2025-03-24 17:52:21 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00995577
Frequency1.4
Structure
Chemical FormulaC6H7NOS
Molecular Mass141.0248
SMILESOCc1cccc(=S)[nH]1
InChI KeyIRDOPEMMYSKKMH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass hydroxypyridines
Direct Parent hydroxypyridines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 2-halopyridines
  • aromatic alcohols
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organopnictogen compounds
  • organosulfur compounds
  • thiolactams
  • Substituents
  • aromatic alcohol
  • alcohol
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • hydroxypyridine
  • organosulfur compound
  • organic oxygen compound
  • thiolactam
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • 2-halopyridine
  • organic nitrogen compound
  • organooxygen compound