Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 08:53:12 UTC
Update Date2025-03-24 20:04:48 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01331042
Frequency1.0
Structure
Chemical FormulaC4H11NOS
Molecular Mass121.0561
SMILESCSCNCCO
InChI KeyHBHSFCATHGPBFU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganosulfur compounds
Classthiohemiaminal derivatives
Subclass thiohemiaminal derivatives
Direct Parent thiohemiaminal derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alcohols and polyols
  • alkanolamines
  • dialkylamines
  • dialkylthioethers
  • hydrocarbon derivatives
  • organopnictogen compounds
  • sulfenyl compounds
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • secondary aliphatic amine
  • sulfenyl compound
  • dialkylthioether
  • secondary amine
  • organic oxygen compound
  • thioether
  • organonitrogen compound
  • hemithioaminal
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine
  • alkanolamine