Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:52:18 UTC
Update Date2025-03-21 18:03:25 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00044080
Frequency76.9
Structure
Chemical FormulaC3H2O7S
Molecular Mass181.9521
SMILESO=C1OC(OS(=O)(=O)O)=C1O
InChI KeyKJEYRZULZSCDGY-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 heteromonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acid esters
  • hydrocarbon derivatives
  • lactones
  • monocarboxylic acids and derivatives
  • organic oxides
  • oxacyclic compounds
  • oxetenes
  • Substituents
  • sulfuric acid monoester
  • carbonyl group
  • carboxylic acid derivative
  • lactone
  • oxacycle
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • aliphatic heteromonocyclic compound
  • sulfate-ester
  • hydrocarbon derivative
  • oxetene
  • organoheterocyclic compound
  • organooxygen compound