Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:54:59 UTC
Update Date2025-03-25 00:51:52 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02189885
Frequency0.5
Structure
Chemical FormulaC9H12S2
Molecular Mass184.038
SMILESC=CCSCc1cscc1C
InChI KeyFJXUMVZOOHAPTP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classheteroaromatic compounds
Subclass heteroaromatic compounds
Direct Parent heteroaromatic compounds
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • allyl sulfur compounds
  • dialkylthioethers
  • hydrocarbon derivatives
  • sulfenyl compounds
  • thiophenes
  • Substituents
  • sulfenyl compound
  • aromatic heteromonocyclic compound
  • thioether
  • dialkylthioether
  • heteroaromatic compound
  • allyl sulfur compound
  • hydrocarbon derivative
  • thiophene
  • organosulfur compound