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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:57:40 UTC
Update Date2025-03-25 00:52:46 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02195878
Frequency0.5
Structure
Chemical FormulaC19H24O3
Molecular Mass300.1725
SMILESCC12CCC3c4ccc(O)cc4CCC3C1CCC2(O)C=O
InChI KeyDVRYQEFOGPPHAY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classsteroids and steroid derivatives
Subclass oxosteroids
Direct Parent 20-oxosteroids
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 17-hydroxysteroids
  • 3-hydroxysteroids
  • aldehydes
  • cyclic alcohols and derivatives
  • estrogens and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • phenanthrenes and derivatives
  • tertiary alcohols
  • tetralins
    • Substituents
  • alcohol
  • tetralin
  • phenanthrene
  • carbonyl group
  • estrane-skeleton
  • 3-hydroxysteroid
  • 1-hydroxy-2-unsubstituted benzenoid
  • hydroxysteroid
  • aldehyde
  • aromatic homopolycyclic compound
  • cyclic alcohol
  • 20-oxosteroid
  • tertiary alcohol
  • organic oxide
  • organic oxygen compound
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound
  • 17-hydroxysteroid
  • estrogen-skeleton