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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:04:18 UTC
Update Date2025-03-21 18:28:32 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00072451
Frequency41.3
Structure
Chemical FormulaC17H19NO3
Molecular Mass285.1365
SMILESCN1C2CC(OC(=O)C=Cc3ccccc3)CC1C1OC12
InChI KeyRYCUEGUEPUUZCW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassphenylpropanoids and polyketides
Classcinnamic acids and derivatives
Subclass cinnamic acids and derivatives
Direct Parent cinnamic acids and derivatives
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • amino acids and derivatives
  • azacyclic compounds
  • benzene and substituted derivatives
  • carbonyl compounds
  • dialkyl ethers
  • enoate esters
  • epoxides
  • fatty acid esters
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • morpholines
  • n-alkylpyrrolidines
  • organic oxides
  • organopnictogen compounds
  • oxacyclic compounds
  • piperidines
  • trialkylamines
  • Substituents
  • fatty acyl
  • monocyclic benzene moiety
  • carbonyl group
  • ether
  • amino acid or derivatives
  • carboxylic acid derivative
  • dialkyl ether
  • alpha,beta-unsaturated carboxylic ester
  • cinnamic acid or derivatives
  • organic oxide
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • pyrrolidine
  • piperidine
  • tertiary amine
  • organoheterocyclic compound
  • enoate ester
  • azacycle
  • n-alkylpyrrolidine
  • tertiary aliphatic amine
  • oxirane
  • oxazinane
  • oxacycle
  • fatty acid ester
  • morpholine
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • amine
  • organooxygen compound