Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 16:26:59 UTC
Update Date2025-03-25 01:26:19 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02401500
Frequency0.5
Structure
Chemical FormulaC7H15NS
Molecular Mass145.0925
SMILESCC(C)CC(=S)N(C)C
InChI KeyXVTKRNXRTWNCGX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganosulfur compounds
Classthioamides
Subclass thioamides
Direct Parent thioamides
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organopnictogen compounds
  • thiocarbonyl compounds
  • thiocarboxylic acid amides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • thioamide
  • thiocarboxylic acid amide
  • organonitrogen compound
  • thiocarbonyl group
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound