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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:14:45 UTC
Update Date2025-03-25 00:59:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02235025
Frequency0.5
Structure
Chemical FormulaC13H19NO6
Molecular Mass285.1212
SMILESCc1ncc(COC2OC(C)C(O)C(O)C2O)cc1O
InChI KeyKECMKYPZMSDZMJ-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
  • acetals
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroxypyridines
  • methylpyridines
  • monosaccharides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • oxanes
  • secondary alcohols
  • Substituents
  • alcohol
  • aromatic heteromonocyclic compound
  • azacycle
  • polyhalopyridine
  • heteroaromatic compound
  • hydroxypyridine
  • monosaccharide
  • methylpyridine
  • oxacycle
  • saccharide
  • organic oxygen compound
  • acetal
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • 2-halopyridine
  • organic nitrogen compound
  • oxane
  • organooxygen compound