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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:01:04 UTC
Update Date2025-03-25 00:54:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02203684
Frequency0.5
Structure
Chemical FormulaC10H17NO3
Molecular Mass199.1208
SMILESO=C(O)CCC1CCN2CC(O)CC12
InChI KeyOHXRSDUMJDGEPY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolizidines
Subclass pyrrolizidines
Direct Parent pyrrolizidines
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • 1,2-aminoalcohols
  • amino acids
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • n-alkylpyrrolidines
  • organic oxides
  • organopnictogen compounds
  • secondary alcohols
  • trialkylamines
    • Substituents
  • carbonyl group
  • carboxylic acid
  • amino acid or derivatives
  • amino acid
  • carboxylic acid derivative
  • aliphatic heteropolycyclic compound
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • pyrrolidine
  • tertiary amine
  • alcohol
  • azacycle
  • n-alkylpyrrolidine
  • 1,2-aminoalcohol
  • tertiary aliphatic amine
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • pyrrolizidine
  • organic nitrogen compound
  • amine
  • organooxygen compound