Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:13:59 UTC
Update Date2025-03-21 18:33:23 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00095549
Frequency29.0
Structure
Chemical FormulaC6H11NO2S
Molecular Mass161.051
SMILESCC(=O)C(=O)CSCCN
InChI KeyJGFZCZUHEHSMIP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent alpha-diketones
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • dialkylthioethers
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • sulfenyl compounds
  • Substituents
  • aliphatic acyclic compound
  • sulfenyl compound
  • dialkylthioether
  • organosulfur compound
  • alpha-diketone
  • organic oxide
  • thioether
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound