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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:21:11 UTC
Update Date2025-03-25 01:01:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02249822
Frequency0.5
Structure
Chemical FormulaC7H15NO13S3
Molecular Mass416.9706
SMILESCS(=O)(=O)OCC1OC(O)C(NS(=O)(=O)O)C(O)C1OS(=O)(=O)O
InChI KeyXRCOUSOSDODHKP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbohydrates and carbohydrate conjugates
Direct Parent monosaccharides
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • alkyl sulfates
  • hemiacetals
  • hydrocarbon derivatives
  • methanesulfonates
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • organosulfonic acid esters
  • oxacyclic compounds
  • oxanes
  • secondary alcohols
  • sulfonic acid esters
  • sulfonyls
  • sulfuric acid monoamides
  • sulfuric acid monoesters
    • Substituents
  • organosulfonic acid or derivatives
  • sulfuric acid monoester
  • monosaccharide
  • organosulfur compound
  • sulfonic acid ester
  • organic oxide
  • alkyl sulfate
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hemiacetal
  • oxane
  • organoheterocyclic compound
  • alcohol
  • organic sulfuric acid or derivatives
  • organosulfonic acid ester
  • methanesulfonate
  • oxacycle
  • sulfonyl
  • organic sulfonic acid or derivatives
  • sulfuric acid monoamide
  • secondary alcohol
  • sulfate-ester
  • hydrocarbon derivative
  • organic nitrogen compound
  • sulfuric acid ester