Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:49:40 UTC
Update Date2025-03-25 00:49:57 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02177782
Frequency0.5
Structure
Chemical FormulaC10H14O2S
Molecular Mass198.0715
SMILESCc1ccc(C(C)C)cc1S(=O)O
InChI KeyFRFNENMMASLCGY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classprenol lipids
Subclass monoterpenoids
Direct Parent aromatic monoterpenoids
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • cumenes
  • hydrocarbon derivatives
  • monocyclic monoterpenoids
  • organic oxides
  • organosulfur compounds
  • phenylpropanes
  • sulfinic acids
  • toluenes
  • Substituents
  • monocyclic benzene moiety
  • monocyclic monoterpenoid
  • sulfinic acid derivative
  • p-cymene
  • organosulfur compound
  • sulfinic acid
  • phenylpropane
  • aromatic homomonocyclic compound
  • organic oxide
  • organic oxygen compound
  • cumene
  • hydrocarbon derivative
  • benzenoid
  • toluene
  • aromatic monoterpenoid