Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:46:08 UTC
Update Date2025-03-25 00:48:41 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02169581
Frequency0.5
Structure
Chemical FormulaC9H12S2
Molecular Mass184.038
SMILESCCSSCc1ccccc1
InChI KeyNXTTXALMMJDDQD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzene and substituted derivatives
Direct Parent benzene and substituted derivatives
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • dialkyldisulfides
  • hydrocarbon derivatives
  • sulfenyl compounds
  • Substituents
  • aromatic homomonocyclic compound
  • dialkyldisulfide
  • monocyclic benzene moiety
  • sulfenyl compound
  • organic disulfide
  • hydrocarbon derivative
  • organosulfur compound