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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:41:16 UTC
Update Date2025-03-25 00:46:58 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02158574
Frequency0.5
Structure
Chemical FormulaC15H12O2S
Molecular Mass256.0558
SMILESOC1=Cc2ccccc2SC1c1ccc(O)cc1
InChI KeyBITKXRRDYSNWIS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classthiochromenes
Subclass thiochromenes
Direct Parent thiochromenes
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-benzothiopyrans
  • 1-hydroxy-2-unsubstituted benzenoids
  • alkylarylthioethers
  • benzene and substituted derivatives
  • hydrocarbon derivatives
  • organooxygen compounds
  • thiopyrans
    • Substituents
  • monocyclic benzene moiety
  • benzothiopyran
  • 2h-thiochromene
  • 1-hydroxy-2-unsubstituted benzenoid
  • alkylarylthioether
  • thiopyran
  • aryl thioether
  • 1-benzothiopyran
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • thioether
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound