Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:29:49 UTC
Update Date2025-03-21 18:41:19 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00133666
Frequency18.8
Structure
Chemical FormulaC7H15NOS
Molecular Mass161.0874
SMILESCCC(C)C(N)C(=O)CS
InChI KeyFOAWPQJRALLESI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent ketones
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkylthiols
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • organosulfur compounds
  • Substituents
  • aliphatic acyclic compound
  • organosulfur compound
  • ketone
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • alkylthiol