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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:37:33 UTC
Update Date2025-03-25 00:45:36 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02150078
Frequency0.5
Structure
Chemical FormulaC8H13NO3
Molecular Mass171.0895
SMILESO=C1C(O)C(O)CC2CCCN12
InChI KeyXTYABBGEXQTGER-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classindolizidines
Subclass indolizidines
Direct Parent indolizidines
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • 1,2-diols
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • delta lactams
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • piperidinones
  • pyrrolidines
  • secondary alcohols
  • tertiary carboxylic acid amides
    • Substituents
  • alcohol
  • carbonyl group
  • lactam
  • indolizidine
  • azacycle
  • carboxamide group
  • carboxylic acid derivative
  • delta-lactam
  • aliphatic heteropolycyclic compound
  • organic oxide
  • organic oxygen compound
  • tertiary carboxylic acid amide
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • piperidinone
  • hydrocarbon derivative
  • organic nitrogen compound
  • pyrrolidine
  • piperidine
  • organooxygen compound
  • 1,2-diol