Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:39:15 UTC
Update Date2025-03-21 21:54:32 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00436474
Frequency4.1
Structure
Chemical FormulaC7H13NS
Molecular Mass143.0769
SMILESCN1C2CCC1CSC2
InChI KeyURLSQBKAIPMXCJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classthiepanes
Subclass thiepanes
Direct Parent thiepanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • dialkylthioethers
  • hydrocarbon derivatives
  • n-alkylpyrrolidines
  • organopnictogen compounds
  • thiomorpholines
  • trialkylamines
  • Substituents
  • 1,4-thiazinane
  • azacycle
  • n-alkylpyrrolidine
  • dialkylthioether
  • tertiary aliphatic amine
  • aliphatic heteropolycyclic compound
  • thioether
  • organonitrogen compound
  • thiepane
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • pyrrolidine
  • amine
  • tertiary amine