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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:13:19 UTC
Update Date2025-03-25 00:58:36 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02231731
Frequency0.5
Structure
Chemical FormulaC25H40O4
Molecular Mass404.2927
SMILESCC12CCC(O)CC1CCC1(C)C3CCC4(C)C(CCC4(O)C(=O)O)C3CCC21
InChI KeyUDZSXUGRLVHLAL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classsteroids and steroid derivatives
Subclass hydroxysteroids
Direct Parent 17-hydroxysteroids
Geometric Descriptor aliphatic homopolycyclic compounds
Alternative Parents
  • alpha hydroxy acids and derivatives
  • carbonyl compounds
  • carboxylic acids
  • cyclic alcohols and derivatives
  • estrane steroids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • secondary alcohols
  • tertiary alcohols
  • Substituents
  • alcohol
  • carbonyl group
  • carboxylic acid
  • estrane-skeleton
  • alpha-hydroxy acid
  • hydroxy acid
  • cyclic alcohol
  • carboxylic acid derivative
  • aliphatic homopolycyclic compound
  • tertiary alcohol
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • organooxygen compound
  • 17-hydroxysteroid