Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:01:19 UTC
Update Date2025-03-25 00:54:08 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02204283
Frequency0.5
Structure
Chemical FormulaC12H8OS2
Molecular Mass232.0017
SMILESOc1cccc2c1Sc1ccccc1S2
InChI KeyJQAJUHWNEZOAJJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzodithiins
Subclass 1,4-benzodithiins
Direct Parent thianthrenes
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • benzenoids
  • diarylthioethers
  • hydrocarbon derivatives
  • organoheterocyclic compounds
  • organooxygen compounds
  • Substituents
  • 1-hydroxy-2-unsubstituted benzenoid
  • thianthrene
  • 1-hydroxy-4-unsubstituted benzenoid
  • aryl thioether
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • thioether
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound
  • diarylthioether