Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:54:59 UTC
Update Date2025-03-25 00:51:52 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02189880
Frequency0.5
Structure
Chemical FormulaC5H12NO3S+
Molecular Mass166.0532
SMILESC=CC[N+](C)(C)S(=O)(=O)O
InChI KeyTZICIRZRXUXNDR-UHFFFAOYSA-O
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classorganic sulfuric acids and derivatives
Subclass organic sulfuric acids and derivatives
Direct Parent organic sulfuric acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organic cations
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • organic oxide
  • organic sulfuric acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic cation