Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:23:21 UTC
Update Date2025-03-25 01:02:15 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02254679
Frequency0.5
Structure
Chemical FormulaC21H32O3
Molecular Mass332.2351
SMILESCC12CCC3=C(CCC4C3(C)CC(O)C(O)C4(C)C)C1CCC2=O
InChI KeyGQHAFHIJDWYLLW-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
  • 1,2-diols
  • 17-oxosteroids
  • 3-hydroxysteroids
  • cyclic alcohols and derivatives
  • diterpenoids
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • secondary alcohols
  • Substituents
  • alcohol
  • carbonyl group
  • oxosteroid
  • androgen-skeleton
  • abietane diterpenoid
  • 3-hydroxysteroid
  • hydroxysteroid
  • cyclic alcohol
  • aliphatic homopolycyclic compound
  • ketone
  • organic oxide
  • organic oxygen compound
  • 2-hydroxysteroid
  • secondary alcohol
  • 17-oxosteroid
  • hydrocarbon derivative
  • diterpenoid
  • organooxygen compound
  • 1,2-diol