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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:57:39 UTC
Update Date2025-03-25 00:52:45 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02195838
Frequency0.5
Structure
Chemical FormulaC22H38O7
Molecular Mass414.2618
SMILESCC12C(CCC3C1C(O)CC1(C)C3CCC1(O)C(O)CO)C(O)CC2C(O)CO
InChI KeyACFTVPYUIAIWPF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classsteroids and steroid derivatives
Subclass androstane steroids
Direct Parent androstane steroids
Geometric Descriptor aliphatic homopolycyclic compounds
Alternative Parents
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • primary alcohols
  • secondary alcohols
  • tertiary alcohols
  • Substituents
  • alcohol
  • cyclic alcohol
  • aliphatic homopolycyclic compound
  • tertiary alcohol
  • organic oxygen compound
  • androstane-skeleton
  • secondary alcohol
  • hydrocarbon derivative
  • primary alcohol
  • organooxygen compound