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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:01:10 UTC
Update Date2025-03-25 00:54:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02203925
Frequency0.5
Structure
Chemical FormulaC12H21NO9
Molecular Mass323.1216
SMILESOCC1N=CC(OC2OC(CO)C(O)C(O)C2O)C(O)C1O
InChI KeySDLGYSIBFDGNTQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass hydropyridines
Direct Parent tetrahydropyridines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • acetals
  • azacyclic compounds
  • hydrocarbon derivatives
  • imines
  • monosaccharides
  • organopnictogen compounds
  • oxacyclic compounds
  • oxanes
  • primary alcohols
  • propargyl-type 1,3-dipolar organic compounds
  • secondary alcohols
    • Substituents
  • alcohol
  • azacycle
  • imine
  • monosaccharide
  • tetrahydropyridine
  • organic 1,3-dipolar compound
  • propargyl-type 1,3-dipolar organic compound
  • oxacycle
  • saccharide
  • organic oxygen compound
  • acetal
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • oxane
  • primary alcohol
  • organooxygen compound