Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:03:33 UTC
Update Date2025-03-25 00:54:54 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02209420
Frequency0.5
Structure
Chemical FormulaC22H34O5
Molecular Mass378.2406
SMILESCC1=CC(=O)CC2(C)C1CCC1C2C(O)CC2(C)C1CCC2(O)C(O)CO
InChI KeyUDJGNSZFQMSUAE-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
  • cyclic alcohols and derivatives
  • cyclohexenones
  • hydrocarbon derivatives
  • organic oxides
  • oxosteroids
  • pregnane steroids
  • primary alcohols
  • secondary alcohols
  • tertiary alcohols
  • Substituents
  • alcohol
  • cyclohexenone
  • carbonyl group
  • oxosteroid
  • 2-oxosteroid
  • cyclic ketone
  • cyclic alcohol
  • aliphatic homopolycyclic compound
  • ketone
  • tertiary alcohol
  • organic oxide
  • organic oxygen compound
  • 21-hydroxysteroid
  • secondary alcohol
  • hydrocarbon derivative
  • 11-hydroxysteroid
  • primary alcohol
  • pregnane-skeleton
  • organooxygen compound
  • 17-hydroxysteroid