Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:20:32 UTC
Update Date2025-03-21 18:36:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00111623
Frequency23.8
Structure
Chemical FormulaC7H12O10S
Molecular Mass288.0151
SMILESCOS(=O)(=O)OC1OC(C(=O)O)C(O)C(O)C1O
InChI KeyYOZUQNYLLVTRSC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbohydrates and carbohydrate conjugates
Direct Parent glucuronic acid derivatives
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • alkyl sulfates
  • beta hydroxy acids and derivatives
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • monosaccharides
  • organic oxides
  • oxacyclic compounds
  • oxanes
  • pyran carboxylic acids
  • secondary alcohols
  • sulfuric acid diesters
  • Substituents
  • carbonyl group
  • carboxylic acid
  • glucuronic acid or derivatives
  • monosaccharide
  • carboxylic acid derivative
  • pyran carboxylic acid
  • beta-hydroxy acid
  • organic oxide
  • sulfuric acid diester
  • alkyl sulfate
  • aliphatic heteromonocyclic compound
  • oxane
  • organoheterocyclic compound
  • alcohol
  • pyran carboxylic acid or derivatives
  • organic sulfuric acid or derivatives
  • hydroxy acid
  • oxacycle
  • monocarboxylic acid or derivatives
  • pyran
  • secondary alcohol
  • hydrocarbon derivative
  • sulfuric acid ester