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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:44:02 UTC
Update Date2025-03-24 17:56:43 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01019956
Frequency1.4
Structure
Chemical FormulaC6H11NS
Molecular Mass129.0612
SMILESCC1=NCCCCS1
InChI KeyTUAKXHYTJDNJRH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classthiazepines
Subclass meta thiazepines
Direct Parent meta thiazepines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • meta-thiazepine
  • azacycle
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic 1,3-dipolar compound
  • organic nitrogen compound
  • propargyl-type 1,3-dipolar organic compound