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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:20:43 UTC
Update Date2025-03-21 18:36:43 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00112083
Frequency23.7
Structure
Chemical FormulaC19H30O6S
Molecular Mass386.1763
SMILESCC12CC(O)C3C(CCC4CC(OS(=O)(=O)O)CCC43C)C1CCC2=O
InChI KeyKHCLVDKEVGLECM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classsteroids and steroid derivatives
Subclass hydroxysteroids
Direct Parent hydroxysteroids
Geometric Descriptor aliphatic homopolycyclic compounds
Alternative Parents
  • 11-hydroxysteroids
  • 17-oxosteroids
  • alkyl sulfates
  • androstane steroids
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • secondary alcohols
  • sulfated steroids
  • sulfuric acid monoesters
    • Substituents
  • sulfuric acid monoester
  • carbonyl group
  • sulfated steroid
  • 3-sulfated steroid
  • aliphatic homopolycyclic compound
  • ketone
  • organic oxide
  • alkyl sulfate
  • alcohol
  • organic sulfuric acid or derivatives
  • oxosteroid
  • hydroxysteroid
  • cyclic alcohol
  • organic oxygen compound
  • androstane-skeleton
  • sulfated steroid skeleton
  • secondary alcohol
  • sulfate-ester
  • 17-oxosteroid
  • hydrocarbon derivative
  • 11-hydroxysteroid
  • sulfuric acid ester
  • organooxygen compound