Hmdb loader
Record Information
HMDB Statuspredicted
Creation Date2024-02-21 00:03:53 UTC
Update Date2025-03-21 18:28:22 UTC
HMDB IDHMDB0142542
Metabolite Identification
DeepMet IDDMID00071438
Name[2-(dimethylamino)ethoxy]sulfonic acid
Frequency42.0
Structure
Chemical FormulaC4H11NO4S
Molecular Mass169.0409
SMILESCN(C)CCOS(=O)(=O)O
InChI KeyWYVFVMUROJPJSS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classorganic sulfuric acids and derivatives
Subclass sulfuric acid esters
Direct Parent sulfuric acid monoesters
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkyl sulfates
  • hydrocarbon derivatives
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • trialkylamines
  • Substituents
  • aliphatic acyclic compound
  • sulfuric acid monoester
  • tertiary aliphatic amine
  • organic oxide
  • organic oxygen compound
  • alkyl sulfate
  • organonitrogen compound
  • organopnictogen compound
  • sulfate-ester
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • tertiary amine
  • organooxygen compound