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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:49:00 UTC
Update Date2025-03-25 00:49:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02176210
Frequency0.5
Structure
Chemical FormulaC29H50O3
Molecular Mass446.376
SMILESCC(CC(O)C(C)(C)CO)C1CCC2C3=C(CCC21C)C1(C)CCC(O)C(C)(C)C1CC3
InChI KeyVUDLLEAISIYBQV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classsteroids and steroid derivatives
Subclass bile acids, alcohols and derivatives
Direct Parent bile acids, alcohols and derivatives
Geometric Descriptor aliphatic homopolycyclic compounds
Alternative Parents
  • 3-hydroxysteroids
  • cyclic alcohols and derivatives
  • diterpenoids
  • fatty alcohols
  • hydrocarbon derivatives
  • secondary alcohols
    • Substituents
  • alcohol
  • fatty acyl
  • abietane diterpenoid
  • 25-hydroxysteroid
  • 23-hydroxysteroid
  • 3-hydroxysteroid
  • hydroxysteroid
  • cyclic alcohol
  • bile acid, alcohol, or derivatives
  • aliphatic homopolycyclic compound
  • organic oxygen compound
  • fatty alcohol
  • secondary alcohol
  • hydrocarbon derivative
  • diterpenoid
  • organooxygen compound