Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:26:08 UTC
Update Date2025-03-21 18:39:18 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00124977
Frequency20.6
Structure
Chemical FormulaC45H76O2
Molecular Mass648.5845
SMILESCCCCCCC=CCCCCCCCCCC(=O)OC1CCC2(C)C(=CCC3C2=CCC2(C)C(C(C)CCCC(C)C)CCC32)C1
InChI KeyQUDKDVVUHXIVPN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classsteroids and steroid derivatives
Subclass cholestane steroids
Direct Parent cholestane steroids
Geometric Descriptor aliphatic homopolycyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acid esters
  • delta-5-steroids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • steroid esters
  • Substituents
  • delta-5-steroid
  • carbonyl group
  • carboxylic acid derivative
  • steroid ester
  • aliphatic homopolycyclic compound
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • hydrocarbon derivative
  • cholestane-skeleton
  • organooxygen compound