Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:21:19 UTC
Update Date2025-03-25 01:01:33 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02250138
Frequency0.5
Structure
Chemical FormulaC9H13NS2
Molecular Mass199.0489
SMILESCSCCSCc1ccccn1
InChI KeyPVWNLRDKYCMPMK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass methylpyridines
Direct Parent methylpyridines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 2-halopyridines
  • azacyclic compounds
  • dialkylthioethers
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organopnictogen compounds
  • sulfenyl compounds
  • Substituents
  • sulfenyl compound
  • aromatic heteromonocyclic compound
  • azacycle
  • dialkylthioether
  • heteroaromatic compound
  • methylpyridine
  • organosulfur compound
  • thioether
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • 2-halopyridine
  • organic nitrogen compound