Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:47:07 UTC
Update Date2025-03-25 00:49:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02171863
Frequency0.5
Structure
Chemical FormulaC11H15NS
Molecular Mass193.0925
SMILESCN(C)CC1CSc2ccccc21
InChI KeyTTXXJPIIGZGFRS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganosulfur compounds
Classthioethers
Subclass aryl thioethers
Direct Parent aryl thioethers
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alkylarylthioethers
  • benzenoids
  • hydrocarbon derivatives
  • organoheterocyclic compounds
  • organopnictogen compounds
  • trialkylamines
  • Substituents
  • tertiary aliphatic amine
  • alkylarylthioether
  • aryl thioether
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • amine
  • tertiary amine
  • organoheterocyclic compound