Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:59:54 UTC
Update Date2025-03-21 18:06:14 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00061993
Frequency50.1
Structure
Chemical FormulaC22H38O6
Molecular Mass398.2668
SMILESCC12CCC(O)CC1CCC1C2C(O)CC2(C)C1CCC2(O)C(O)C(O)CO
InChI KeyLQVHGFIJGZOZAP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classsteroids and steroid derivatives
Subclass androstane steroids
Direct Parent androgens and derivatives
Geometric Descriptor aliphatic homopolycyclic compounds
Alternative Parents
  • 11-hydroxysteroids
  • 17-hydroxysteroids
  • 3-hydroxysteroids
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • primary alcohols
  • secondary alcohols
  • tertiary alcohols
  • Substituents
  • 20-hydroxysteroid
  • alcohol
  • androgen-skeleton
  • 3-hydroxysteroid
  • hydroxysteroid
  • cyclic alcohol
  • aliphatic homopolycyclic compound
  • tertiary alcohol
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • 11-hydroxysteroid
  • primary alcohol
  • organooxygen compound
  • 17-hydroxysteroid