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 IDDMID02254680
Frequency0.5
Structure
Chemical FormulaC28H46O4
Molecular Mass446.3396
SMILESCC12CCC3C(C)(C)C(O)CCC3(C)C1CCC1=C2CCC2(C)C1CCC2(O)C(O)CO
InChI KeyTXJOYAKRNFMJMA-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
  • 17-hydroxysteroids
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • primary alcohols
  • secondary alcohols
  • tertiary alcohols
  • Substituents
  • alcohol
  • cyclic alcohol
  • aliphatic homopolycyclic compound
  • tertiary alcohol
  • organic oxygen compound
  • 21-hydroxysteroid
  • secondary alcohol
  • hydrocarbon derivative
  • primary alcohol
  • organooxygen compound
  • 17-hydroxysteroid