Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 12:58:41 UTC
Update Date2025-03-24 21:52:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01916405
Frequency0.6
Structure
Chemical FormulaC7H15NS
Molecular Mass145.0925
SMILESNCC1CCC(S)CC1
InChI KeyAERDRVAPUCOKHP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganosulfur compounds
Classthiols
Subclass alkylthiols
Direct Parent alkylthiols
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organopnictogen compounds
  • organosulfur compounds
  • Substituents
  • organonitrogen compound
  • aliphatic homomonocyclic compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • alkylthiol