Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:11:59 UTC
Update Date2025-03-21 18:32:24 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00090730
Frequency31.0
Structure
Chemical FormulaC10H14OS
Molecular Mass182.0765
SMILESCS(=O)CCCc1ccccc1
InChI KeyJHXQPKDLLLSOKV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzene and substituted derivatives
Direct Parent benzene and substituted derivatives
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organic oxides
  • sulfinyl compounds
  • sulfoxides
  • Substituents
  • aromatic homomonocyclic compound
  • monocyclic benzene moiety
  • organic oxide
  • organic oxygen compound
  • sulfinyl compound
  • sulfoxide
  • hydrocarbon derivative
  • organosulfur compound