Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:23:59 UTC
Update Date2025-03-21 18:38:16 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00119956
Frequency21.7
Structure
Chemical FormulaC9H10O3S
Molecular Mass198.0351
SMILESOC1Sc2ccccc2C(O)C1O
InChI KeyLMAYEORXPGDOPK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classthiochromanes
Subclass thiochromanes
Direct Parent thiochromanes
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1,2-diols
  • 1-benzothiopyrans
  • aryl thioethers
  • benzenoids
  • hydrocarbon derivatives
  • secondary alcohols
  • thiopyrans
  • Substituents
  • thiochromane
  • alcohol
  • benzothiopyran
  • thiopyran
  • aryl thioether
  • 1-benzothiopyran
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • secondary alcohol
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound
  • 1,2-diol