Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:32:44 UTC
Update Date2025-03-24 14:28:28 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00849539
Frequency1.7
Structure
Chemical FormulaC4H13NO2S
Molecular Mass139.0667
SMILESCNCC[SH](C)(=O)O
InChI KeyXPPQYRWEFDVEMT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganosulfur compounds
Classthiols
Subclass alkylthiols
Direct Parent alkylthiols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • dialkylamines
  • hydrocarbon derivatives
  • organic oxides
  • organopnictogen compounds
  • organosulfur compounds
  • Substituents
  • aliphatic acyclic compound
  • secondary aliphatic amine
  • secondary amine
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • alkylthiol
  • amine