Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:02:00 UTC
Update Date2025-03-21 18:07:04 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00066938
Frequency45.5
Structure
Chemical FormulaC11H17NOS
Molecular Mass211.1031
SMILESC=CCSCc1ccc(CN(C)C)o1
InChI KeyCDFYRJROZCTVGI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent aralkylamines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • allyl sulfur compounds
  • dialkylthioethers
  • furans
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organooxygen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • sulfenyl compounds
  • trialkylamines
  • Substituents
  • furan
  • sulfenyl compound
  • aromatic heteromonocyclic compound
  • dialkylthioether
  • heteroaromatic compound
  • allyl sulfur compound
  • tertiary aliphatic amine
  • organosulfur compound
  • aralkylamine
  • oxacycle
  • organic oxygen compound
  • thioether
  • organopnictogen compound
  • hydrocarbon derivative
  • tertiary amine
  • organoheterocyclic compound
  • organooxygen compound