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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:45:25 UTC
Update Date2025-03-25 00:48:24 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02167970
Frequency0.5
Structure
Chemical FormulaC27H46O3
Molecular Mass418.3447
SMILESCC(C)CCCC(C)C1C(O)CC2C3CC=C4CC(O)CCC4(C)C3CC(O)C21C
InChI KeyPCKILVFIQJQVTM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classsteroids and steroid derivatives
Subclass cholestane steroids
Direct Parent cholesterols and derivatives
Geometric Descriptor aliphatic homopolycyclic compounds
Alternative Parents
  • 12-hydroxysteroids
  • 16-hydroxysteroids
  • 3-hydroxy delta-5-steroids
  • cyclic alcohols and derivatives
  • delta-5-steroids
  • hydrocarbon derivatives
  • secondary alcohols
    • Substituents
  • delta-5-steroid
  • alcohol
  • 12-hydroxysteroid
  • 3-hydroxysteroid
  • cholesterol-skeleton
  • 16-hydroxysteroid
  • hydroxysteroid
  • 3-hydroxy-delta-5-steroid
  • cyclic alcohol
  • cholesterol
  • aliphatic homopolycyclic compound
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • organooxygen compound