Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:17:52 UTC
Update Date2025-03-21 18:35:21 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00105118
Frequency25.7
Structure
Chemical FormulaC28H46O2
Molecular Mass414.3498
SMILESCC(=O)CCCC(C)C1CCC2C3=C(CCC21C)C1(C)CCC(O)C(C)(C)C1CC3
InChI KeyJSBIPDXWUPKGDL-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
  • 3-hydroxysteroids
  • cyclic alcohols and derivatives
  • diterpenoids
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • oxosteroids
  • secondary alcohols
  • Substituents
  • alcohol
  • carbonyl group
  • 25-oxosteroid
  • oxosteroid
  • androgen-skeleton
  • abietane diterpenoid
  • 3-hydroxysteroid
  • hydroxysteroid
  • cyclic alcohol
  • aliphatic homopolycyclic compound
  • ketone
  • organic oxide
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • diterpenoid
  • organooxygen compound