Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:49:29 UTC
Update Date2025-03-25 00:49:53 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02177331
Frequency0.5
Structure
Chemical FormulaC13H10OS
Molecular Mass214.0452
SMILESCc1ccc2c(c1)Oc1ccccc1S2
InChI KeyKULZSEHSBJKPDU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzoxathiins
Subclass phenoxathiins
Direct Parent phenoxathiins
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • benzenoids
  • diarylethers
  • diarylthioethers
  • hydrocarbon derivatives
  • oxacyclic compounds
  • oxathiins
  • Substituents
  • diaryl ether
  • ether
  • phenoxathiin
  • aryl thioether
  • oxacycle
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • thioether
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound
  • diarylthioether
  • 1,4-oxathiin