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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:11:45 UTC
Update Date2025-03-25 00:58:03 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02228276
Frequency0.5
Structure
Chemical FormulaC11H18N2O3
Molecular Mass226.1317
SMILESC=CC1(O)CN2CCC1N(C)C2C(=O)OC
InChI KeyLTAZFQLWYRFECY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alpha amino acid esters
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • alpha amino acids
  • azacyclic compounds
  • carbonyl compounds
  • diazinanes
  • hydrocarbon derivatives
  • methyl esters
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • piperidines
  • tertiary alcohols
  • Substituents
  • alcohol
  • carbonyl group
  • alpha-amino acid ester
  • azacycle
  • aliphatic heteropolycyclic compound
  • 1,3-diazinane
  • tertiary alcohol
  • organic oxide
  • monocarboxylic acid or derivatives
  • methyl ester
  • organic oxygen compound
  • carboxylic acid ester
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • piperidine
  • organoheterocyclic compound
  • organooxygen compound