Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:43:31 UTC
Update Date2025-03-25 00:47:43 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02163595
Frequency0.5
Structure
Chemical FormulaC22H36O4
Molecular Mass364.2614
SMILESCC12CCC(O)CC1CCC1C2CCC2C1(C)CCC(O)C2(C)C(=O)O
InChI KeySCSGFEFMKLVYPI-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
  • beta hydroxy acids and derivatives
  • carbonyl compounds
  • carboxylic acids
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • secondary alcohols
  • Substituents
  • alcohol
  • carbonyl group
  • carboxylic acid
  • hydroxysteroid
  • hydroxy acid
  • cyclic alcohol
  • carboxylic acid derivative
  • aliphatic homopolycyclic compound
  • beta-hydroxy acid
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • 15-hydroxysteroid
  • organooxygen compound