Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:37:48 UTC
Update Date2025-03-25 00:45:41 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02150667
Frequency0.5
Structure
Chemical FormulaC12H23NO16S2
Molecular Mass501.0458
SMILESCOC1OC(OC2OC(CO)C(O)C(O)C2OS(=O)(=O)O)C(O)C(NS(=O)(=O)O)C1O
InChI KeyQDZYMLTVPSTXLH-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
  • acetals
  • alkyl sulfates
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • oxanes
  • primary alcohols
  • secondary alcohols
  • sulfuric acid monoamides
  • sulfuric acid monoesters
  • Substituents
  • alcohol
  • sulfuric acid monoester
  • organic sulfuric acid or derivatives
  • monosaccharide
  • oxacycle
  • organic oxide
  • acetal
  • alkyl sulfate
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • sulfuric acid monoamide
  • secondary alcohol
  • organopnictogen compound
  • sulfate-ester
  • hydrocarbon derivative
  • organic nitrogen compound
  • oxane
  • sulfuric acid ester
  • primary alcohol
  • organoheterocyclic compound