| Record Information |
|---|
| HMDB Status | quantified |
|---|
| Creation Date | 2024-02-21 00:17:27 UTC |
|---|
| Update Date | 2025-03-21 18:35:08 UTC |
|---|
| HMDB ID | HMDB0006736 |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00104098 |
|---|
| Name | CE(20:3) |
|---|
| Frequency | 26.1 |
|---|
| Structure | |
|---|
| Chemical Formula | C47H78O2 |
|---|
| Molecular Mass | 674.6002 |
|---|
| SMILES | CCCCCC=CCC=CCC=CCCCCCCC(=O)OC1CCC2(C)C(=CCC3C2CCC2(C)C(C(C)CCCC(C)C)CCC32)C1 |
|---|
| InChI Key | MLPRJPSMAFZPLA-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | lipids and lipid-like molecules |
|---|
| Class | steroids and steroid derivatives |
|---|
| Subclass | steroid esters |
|---|
| Direct Parent | cholesteryl esters |
|---|
| Geometric Descriptor | aliphatic homopolycyclic compounds |
|---|
| Alternative Parents | carbonyl compoundscarboxylic acid esterscholesterols and derivativesdelta-5-steroidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxides |
|---|
| Substituents | delta-5-steroidcarbonyl groupcarboxylic acid derivativecholesterolaliphatic homopolycyclic compoundorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esterhydrocarbon derivativecholestane-skeletoncholesteryl esterorganooxygen compound |
|---|
