Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:23:24 UTC
Update Date2025-03-21 18:38:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00118599
Frequency22.0
Structure
Chemical FormulaC21H34O3
Molecular Mass334.2508
SMILESCC(=O)C1CCC2C3CCC4CC(O)CCC4(C)C3C(O)CC12C
InChI KeyNFVCQZNBRFPYOP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classsteroids and steroid derivatives
Subclass pregnane steroids
Direct Parent gluco/mineralocorticoids, progestogins and derivatives
Geometric Descriptor aliphatic homopolycyclic compounds
Alternative Parents
  • 11-hydroxysteroids
  • 20-oxosteroids
  • 3-hydroxysteroids
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • secondary alcohols
  • Substituents
  • alcohol
  • carbonyl group
  • oxosteroid
  • 3-hydroxysteroid
  • hydroxysteroid
  • cyclic alcohol
  • 20-oxosteroid
  • aliphatic homopolycyclic compound
  • ketone
  • organic oxide
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • 11-hydroxysteroid
  • progestogin-skeleton
  • organooxygen compound