Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:31:06 UTC
Update Date2025-03-24 17:51:12 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00989295
Frequency1.4
Structure
Chemical FormulaC4H11NOS
Molecular Mass121.0561
SMILESCSC(N)C(C)O
InChI KeyCGMJGNQGTQHDMU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent secondary alcohols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • dialkylthioethers
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organopnictogen compounds
  • sulfenyl compounds
  • thiohemiaminal derivatives
  • Substituents
  • aliphatic acyclic compound
  • sulfenyl compound
  • dialkylthioether
  • organosulfur compound
  • thioether
  • organonitrogen compound
  • secondary alcohol
  • hemithioaminal
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound