Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:27:25 UTC
Update Date2025-03-25 01:03:39 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02263896
Frequency0.5
Structure
Chemical FormulaC2H5NO4S
Molecular Mass138.9939
SMILESNC1COS(=O)(=O)O1
InChI KeyAUTVRYDTEJMMCQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classorganic sulfuric acids and derivatives
Subclass sulfuric acid esters
Direct Parent sulfuric acid diesters
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • alkyl sulfates
  • dioxathiolanes
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • Substituents
  • dioxathiolane
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • sulfuric acid diester
  • alkyl sulfate
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organoheterocyclic compound
  • organooxygen compound