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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:23:22 UTC
Update Date2025-03-25 01:02:16 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02254744
Frequency0.5
Structure
Chemical FormulaC23H36O5
Molecular Mass392.2563
SMILESCC12CCC(O)CC1CCC1C2CCC2(C)C(OC(=O)CCC(=O)O)CCC12
InChI KeySKMZYTSSMPNQOC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classsteroids and steroid derivatives
Subclass steroid esters
Direct Parent steroid esters
Geometric Descriptor aliphatic homopolycyclic compounds
Alternative Parents
  • 3-hydroxysteroids
  • androgens and derivatives
  • carbonyl compounds
  • carboxylic acid esters
  • carboxylic acids
  • cyclic alcohols and derivatives
  • dicarboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • secondary alcohols
  • Substituents
  • alcohol
  • carbonyl group
  • carboxylic acid
  • androgen-skeleton
  • 3-hydroxysteroid
  • hydroxysteroid
  • cyclic alcohol
  • carboxylic acid derivative
  • steroid ester
  • aliphatic homopolycyclic compound
  • organic oxide
  • organic oxygen compound
  • androstane-skeleton
  • carboxylic acid ester
  • secondary alcohol
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • organooxygen compound