Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:03:03 UTC
Update Date2025-03-25 00:54:43 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02208217
Frequency0.5
Structure
Chemical FormulaC21H28O2
Molecular Mass312.2089
SMILESCC(C)c1ccc2c(c1)CCC1C2C(O)CC2(C)C(=O)CCC12
InChI KeyHYUHCKLENNVDHN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classsteroids and steroid derivatives
Subclass estrane steroids
Direct Parent estrane steroids
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • 11-hydroxysteroids
  • 17-oxosteroids
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • phenanthrenes and derivatives
  • secondary alcohols
  • tetralins
  • Substituents
  • alcohol
  • tetralin
  • phenanthrene
  • carbonyl group
  • oxosteroid
  • estrane-skeleton
  • hydroxysteroid
  • aromatic homopolycyclic compound
  • cyclic alcohol
  • ketone
  • organic oxide
  • organic oxygen compound
  • secondary alcohol
  • 17-oxosteroid
  • hydrocarbon derivative
  • 11-hydroxysteroid
  • benzenoid
  • organooxygen compound