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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:51:39 UTC
Update Date2025-03-25 00:50:39 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02182291
Frequency0.5
Structure
Chemical FormulaC10H17NO3
Molecular Mass199.1208
SMILESO=C(O)C1CCCN1C1CCOCC1
InChI KeyVPEJNVLGEJBYLH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent proline and derivatives
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • alpha amino acids
  • amino acids
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • dialkyl ethers
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • n-alkylpyrrolidines
  • organic oxides
  • organopnictogen compounds
  • oxacyclic compounds
  • oxanes
  • pyrrolidine carboxylic acids
  • trialkylamines
  • Substituents
  • carbonyl group
  • ether
  • carboxylic acid
  • amino acid
  • dialkyl ether
  • organic oxide
  • pyrrolidine carboxylic acid
  • aliphatic heteromonocyclic compound
  • alpha-amino acid
  • organonitrogen compound
  • organopnictogen compound
  • oxane
  • pyrrolidine
  • tertiary amine
  • organoheterocyclic compound
  • proline or derivatives
  • azacycle
  • n-alkylpyrrolidine
  • tertiary aliphatic amine
  • oxacycle
  • monocarboxylic acid or derivatives
  • pyrrolidine carboxylic acid or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • organooxygen compound