Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:54:29 UTC
Update Date2025-03-25 00:51:41 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02188735
Frequency0.5
Structure
Chemical FormulaC23H40O6
Molecular Mass412.2825
SMILESCC1(C)CC(O)CC2(C)C3C(O)CC4(C)C(CCC4(O)C(O)CO)C3C(O)CC12
InChI KeyMQFNERPJYHPSRN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classsteroids and steroid derivatives
Subclass hydroxysteroids
Direct Parent 21-hydroxysteroids
Geometric Descriptor aliphatic homopolycyclic compounds
Alternative Parents
  • 11-hydroxysteroids
  • 17-hydroxysteroids
  • 7-hydroxysteroids
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • pregnane steroids
  • primary alcohols
  • secondary alcohols
  • tertiary alcohols
  • Substituents
  • alcohol
  • cyclic alcohol
  • 7-hydroxysteroid
  • aliphatic homopolycyclic compound
  • tertiary alcohol
  • organic oxygen compound
  • 21-hydroxysteroid
  • secondary alcohol
  • hydrocarbon derivative
  • 11-hydroxysteroid
  • primary alcohol
  • pregnane-skeleton
  • organooxygen compound
  • 17-hydroxysteroid