Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:06:16 UTC
Update Date2025-03-21 18:29:24 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00077196
Frequency38.0
Structure
Chemical FormulaC5H9NO4S
Molecular Mass179.0252
SMILESCC1(C)CC(=O)NS(=O)(=O)O1
InChI KeyMDWCVTXHJJMMKF-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 heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • Substituents
  • carbonyl group
  • organic sulfuric acid or derivatives
  • azacycle
  • carboxylic acid derivative
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organoheterocyclic compound
  • organooxygen compound