Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:39:09 UTC
Update Date2025-03-25 00:46:11 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02153864
Frequency0.5
Structure
Chemical FormulaC12H15NOS2
Molecular Mass253.0595
SMILESCS(=O)CCSCc1c[nH]c2ccccc12
InChI KeyODWODOKRFGVVQU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classindoles and derivatives
Subclass indoles
Direct Parent indoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • benzenoids
  • dialkylthioethers
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrroles
  • sulfenyl compounds
  • sulfinyl compounds
  • sulfoxides
  • Substituents
  • sulfenyl compound
  • azacycle
  • indole
  • dialkylthioether
  • heteroaromatic compound
  • organosulfur compound
  • organic oxide
  • organic oxygen compound
  • sulfinyl compound
  • aromatic heteropolycyclic compound
  • thioether
  • pyrrole
  • organonitrogen compound
  • sulfoxide
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound