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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:17:12 UTC
Update Date2025-03-21 18:35:01 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00103473
Frequency26.3
Structure
Chemical FormulaC47H84O2
Molecular Mass680.6471
SMILESCCCCCCC=CCCCCCCCCCC(=O)OC1CCC2(C)C3CCC4(C)C(C(C)CCCC(C)C)CCC4C3CCC2C1(C)C
InChI KeyZHXTXTOJEBAVKH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classprenol lipids
Subclass triterpenoids
Direct Parent triterpenoids
Geometric Descriptor aliphatic homopolycyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acid esters
  • cholesterols and derivatives
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • steroid esters
    • Substituents
  • polycyclic triterpenoid
  • carbonyl group
  • carboxylic acid derivative
  • cholesterol
  • steroid ester
  • aliphatic homopolycyclic compound
  • triterpenoid
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • hydrocarbon derivative
  • cholestane-skeleton
  • organooxygen compound
  • steroid