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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:09:59 UTC
Update Date2025-03-21 18:31:28 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00086068
Frequency33.2
Structure
Chemical FormulaC18H23NO4
Molecular Mass317.1627
SMILESCN1CC2CC(OC(=O)C(CO)c3ccccc3)CC1C1OC21
InChI KeyVRWDFJIJUBJGMV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classepoxypiperidines
Subclass epoxypiperidines
Direct Parent epoxypiperidines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1,4-oxazepines
  • amino acids and derivatives
  • azacyclic compounds
  • azepanes
  • benzene and substituted derivatives
  • beta hydroxy acids and derivatives
  • carbonyl compounds
  • carboxylic acid esters
  • dialkyl ethers
  • epoxides
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • oxacyclic compounds
  • piperidines
  • primary alcohols
  • trialkylamines
  • Substituents
  • monocyclic benzene moiety
  • carbonyl group
  • ether
  • amino acid or derivatives
  • carboxylic acid derivative
  • dialkyl ether
  • beta-hydroxy acid
  • organic oxide
  • epoxypiperidine
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • primary alcohol
  • piperidine
  • tertiary amine
  • alcohol
  • azacycle
  • tertiary aliphatic amine
  • oxirane
  • hydroxy acid
  • para-oxazepine
  • oxacycle
  • monocarboxylic acid or derivatives
  • azepane
  • organic oxygen compound
  • carboxylic acid ester
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • amine
  • organooxygen compound