Hmdb loader
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 IDDMID02195879
Frequency0.5
Structure
Chemical FormulaC19H26O3
Molecular Mass302.1882
SMILESCC12CCC3c4ccc(O)cc4CCC3C1CCC2(O)CO
InChI KeyNINHPFOVRSVKMM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classsteroids and steroid derivatives
Subclass hydroxysteroids
Direct Parent 17-hydroxysteroids
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • 1,2-diols
  • 1-hydroxy-2-unsubstituted benzenoids
  • 3-hydroxysteroids
  • cyclic alcohols and derivatives
  • estrogens and derivatives
  • hydrocarbon derivatives
  • phenanthrenes and derivatives
  • tertiary alcohols
  • tetralins
  • Substituents
  • alcohol
  • tetralin
  • phenanthrene
  • estrane-skeleton
  • 3-hydroxysteroid
  • 1-hydroxy-2-unsubstituted benzenoid
  • aromatic homopolycyclic compound
  • cyclic alcohol
  • tertiary alcohol
  • organic oxygen compound
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound
  • 1,2-diol
  • 17-hydroxysteroid
  • estrogen-skeleton