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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:41:34 UTC
Update Date2025-03-25 00:47:04 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02159235
Frequency0.5
Structure
Chemical FormulaC12H24NO16PS
Molecular Mass501.0553
SMILESO=P(O)(OCC1OC(O)C(NS(=O)(=O)O)C(O)C1O)OC1OC(CO)C(O)C(O)C1O
InChI KeyXWYOCNHEHXOQFC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbohydrates and carbohydrate conjugates
Direct Parent hexose phosphates
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • dialkyl phosphates
  • hemiacetals
  • hydrocarbon derivatives
  • monosaccharides
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • oxanes
  • primary alcohols
  • secondary alcohols
  • sulfuric acid monoamides
    • Substituents
  • organic oxide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hemiacetal
  • oxane
  • primary alcohol
  • organoheterocyclic compound
  • alcohol
  • organic sulfuric acid or derivatives
  • oxacycle
  • dialkyl phosphate
  • phosphoric acid ester
  • sulfuric acid monoamide
  • secondary alcohol
  • hexose phosphate
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic phosphoric acid derivative
  • alkyl phosphate