Hmdb loader

Showing information for DMID02251176

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:21:46 UTC
Update Date2025-03-25 01:01:43 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02251176
Frequency0.5
Structure
Chemical FormulaC8H10O3S
Molecular Mass186.0351
SMILESOCC(O)c1ccc(O)c(S)c1
InChI KeyUPVSJRUCGYGKBO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classthiophenols
Subclass thiophenols
Direct Parent thiophenols
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1,2-diols
  • 1-hydroxy-2-unsubstituted benzenoids
  • aromatic alcohols
  • benzene and substituted derivatives
  • hydrocarbon derivatives
  • primary alcohols
  • secondary alcohols
  • thiols
    • Substituents
  • aromatic alcohol
  • alcohol
  • monocyclic benzene moiety
  • 1-hydroxy-2-unsubstituted benzenoid
  • arylthiol
  • organosulfur compound
  • aromatic homomonocyclic compound
  • thiophenol
  • organic oxygen compound
  • secondary alcohol
  • phenol
  • hydrocarbon derivative
  • primary alcohol
  • organooxygen compound
  • 1,2-diol