Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:15:19 UTC
Update Date2025-03-25 00:59:17 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02236300
Frequency0.5
Structure
Chemical FormulaC9H12O2S
Molecular Mass184.0558
SMILESCOS(=O)c1cc(C)ccc1C
InChI KeyUWCHAMQGLZXQTB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass xylenes
Direct Parent p-xylenes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organic oxides
  • organooxygen compounds
  • organosulfur compounds
  • sulfinic acids and derivatives
  • Substituents
  • aromatic homomonocyclic compound
  • organic oxide
  • p-xylene
  • organic oxygen compound
  • sulfinic acid derivative
  • hydrocarbon derivative
  • organosulfur compound
  • organooxygen compound