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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:02:44 UTC
Update Date2025-03-21 18:07:21 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00068692
Frequency44.1
Structure
Chemical FormulaC6H16N2S
Molecular Mass148.1034
SMILESNCCCCNCCS
InChI KeyACWYWVBPYGPRFJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganosulfur compounds
Classthiols
Subclass alkylthiols
Direct Parent alkylthiols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • dialkylamines
  • hydrocarbon derivatives
  • monoalkylamines
  • organopnictogen compounds
  • organosulfur compounds
    • Substituents
  • aliphatic acyclic compound
  • secondary aliphatic amine
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • secondary amine
  • alkylthiol
  • amine