Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:48:50 UTC
Update Date2025-03-25 00:49:40 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02175800
Frequency0.5
Structure
Chemical FormulaC19H30O4
Molecular Mass322.2144
SMILESCC12CCC3C(C(O)CC4CC(O)CCC43C)C1CC(O)C2=O
InChI KeyGCAYRYHWPQNTIW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classsteroids and steroid derivatives
Subclass androstane steroids
Direct Parent androgens and derivatives
Geometric Descriptor aliphatic homopolycyclic compounds
Alternative Parents
  • 16-hydroxysteroids
  • 17-oxosteroids
  • 3-hydroxysteroids
  • 7-hydroxysteroids
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • secondary alcohols
  • Substituents
  • alcohol
  • carbonyl group
  • oxosteroid
  • androgen-skeleton
  • 3-hydroxysteroid
  • 16-hydroxysteroid
  • hydroxysteroid
  • cyclic alcohol
  • 7-hydroxysteroid
  • aliphatic homopolycyclic compound
  • ketone
  • organic oxide
  • organic oxygen compound
  • secondary alcohol
  • 17-oxosteroid
  • hydrocarbon derivative
  • organooxygen compound