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Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:47:36 UTC
Update Date2025-03-21 18:01:25 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00032778
Frequency111.2
Structure
Chemical FormulaC8H15NO3
Molecular Mass173.1052
SMILESCC(O)C(O)C1CCCC(O)=N1
InChI KeyKOJJOVKUFLABPV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass hydropyridines
Direct Parent tetrahydropyridines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • 1,2-diols
  • azacyclic compounds
  • cyclic carboximidic acids
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • secondary alcohols
    • Substituents
  • alcohol
  • azacycle
  • tetrahydropyridine
  • organic 1,3-dipolar compound
  • propargyl-type 1,3-dipolar organic compound
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • cyclic carboximidic acid
  • organooxygen compound
  • 1,2-diol