Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:11:05 UTC
Update Date2025-03-25 00:57:47 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02226812
Frequency0.5
Structure
Chemical FormulaC6H15N3O3S
Molecular Mass209.0834
SMILESCC(C)CC(O)C(N)=NS(N)(=O)=O
InChI KeyYEORPCPFQQGJIM-UHFFFAOYSA-N
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
  • amidines
  • hydrocarbon derivatives
  • organic oxides
  • organopnictogen compounds
  • secondary alcohols
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • organic sulfuric acid or derivatives
  • amidine
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound