Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:08:07 UTC
Update Date2025-03-21 18:30:16 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00081699
Frequency35.4
Structure
Chemical FormulaC21H34O2
Molecular Mass318.2559
SMILESCC12CCC(O)C(C)(C)C1CCC1=C2CCC2(C)C(O)CCC12
InChI KeyBRXHYLWLFHJAFM-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
  • 17-hydroxysteroids
  • 3-hydroxysteroids
  • cyclic alcohols and derivatives
  • diterpenoids
  • hydrocarbon derivatives
  • secondary alcohols
  • Substituents
  • alcohol
  • androgen-skeleton
  • abietane diterpenoid
  • 3-hydroxysteroid
  • hydroxysteroid
  • cyclic alcohol
  • aliphatic homopolycyclic compound
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • diterpenoid
  • organooxygen compound
  • 17-hydroxysteroid