Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:18:57 UTC
Update Date2025-03-21 23:13:49 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00671865
Frequency2.3
Structure
Chemical FormulaC7H6OS
Molecular Mass138.0139
SMILESOc1ccccc1C=S
InChI KeyNTJTUMLSEVWWTI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenols
Subclass 1-hydroxy-2-unsubstituted benzenoids
Direct Parent 1-hydroxy-2-unsubstituted benzenoids
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-4-unsubstituted benzenoids
  • benzene and substituted derivatives
  • carbonyl compounds
  • hydrocarbon derivatives
  • thioaldehydes
  • Substituents
  • monocyclic benzene moiety
  • carbonyl group
  • thiocarbonyl group
  • 1-hydroxy-2-unsubstituted benzenoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • organosulfur compound
  • aromatic homomonocyclic compound
  • thioaldehyde
  • organic oxygen compound
  • hydrocarbon derivative
  • organooxygen compound