Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 07:02:01 UTC
Update Date2025-03-24 19:51:55 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01062257
Frequency1.3
Structure
Chemical FormulaC2H7NO3S
Molecular Mass125.0147
SMILESNCCO[SH](=O)=O
InChI KeyKWOPJWVXGLXEBO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classorganic sulfonic acids and derivatives
Subclass sulfonic acid esters
Direct Parent sulfonic acid esters
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • Substituents
  • sulfonic acid ester
  • aliphatic acyclic compound
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound