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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:21:34 UTC
Update Date2025-03-21 18:37:08 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00114136
Frequency23.2
Structure
Chemical FormulaC23H34O3
Molecular Mass358.2508
SMILESCC(C)=CC1CC(C)C=C2C=CC(C)C(CCC3CC(O)CC(=O)O3)C21
InChI KeyNYPLVAWUMVYFOD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classprenol lipids
Subclass terpene lactones
Direct Parent terpene lactones
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • bicyclic monoterpenoids
  • carbonyl compounds
  • carboxylic acid esters
  • delta valerolactones
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • oxacyclic compounds
  • oxanes
  • secondary alcohols
  • Substituents
  • alcohol
  • monoterpenoid
  • carbonyl group
  • delta valerolactone
  • carboxylic acid derivative
  • lactone
  • aliphatic heteropolycyclic compound
  • terpene lactone
  • oxacycle
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • secondary alcohol
  • hydrocarbon derivative
  • bicyclic monoterpenoid
  • oxane
  • delta_valerolactone
  • organoheterocyclic compound
  • organooxygen compound