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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:16:14 UTC
Update Date2025-03-25 00:59:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02238353
Frequency0.5
Structure
Chemical FormulaC13H17NO7
Molecular Mass299.1005
SMILESO=C(O)Cc1ccc(C2OC(CO)C(O)C(O)C2O)cn1
InChI KeyUOCBRDITLVKSHJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass halopyridines
Direct Parent polyhalopyridines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 2-halopyridines
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • dialkyl ethers
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroxypyridines
  • monocarboxylic acids and derivatives
  • monosaccharides
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • oxanes
  • primary alcohols
  • secondary alcohols
    • Substituents
  • carbonyl group
  • ether
  • carboxylic acid
  • aromatic heteromonocyclic compound
  • polyhalopyridine
  • monosaccharide
  • carboxylic acid derivative
  • dialkyl ether
  • saccharide
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • 2-halopyridine
  • oxane
  • primary alcohol
  • alcohol
  • azacycle
  • heteroaromatic compound
  • hydroxypyridine
  • oxacycle
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound