EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C41H68O5 |
| Net Charge | 0 |
| Average Mass | 640.990 |
| Monoisotopic Mass | 640.50668 |
| SMILES | [H][C@](CO)(COC(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)OC(=O)CCCCCCCCC/C=C\CCCCCC |
| InChI | InChI=1S/C41H68O5/c1-3-5-7-9-11-13-15-17-19-20-22-23-25-27-29-31-33-35-40(43)45-38-39(37-42)46-41(44)36-34-32-30-28-26-24-21-18-16-14-12-10-8-6-4-2/h5,7,11,13-14,16-17,19,22-23,27,29,39,42H,3-4,6,8-10,12,15,18,20-21,24-26,28,30-38H2,1-2H3/b7-5-,13-11-,16-14-,19-17-,23-22-,29-27-/t39-/m0/s1 |
| InChIKey | BQHUTGIHYWQLEF-OCKRNHPSSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | blood (UBERON:0000178) | PubMed (20671299) |
| Roles Classification |
|---|
| Biological Roles: | Saccharomyces cerevisiae metabolite Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ). human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| DG(20:5(5Z,8Z,11Z,14Z,17Z)/18:1(11Z)/0:0) (CHEBI:89670) is a diglyceride (CHEBI:18035) |
| Synonyms | Source |
|---|---|
| DG(20:5w3/18:1w7) | HMDB |
| DG(38:6) | HMDB |
| Diacylglycerol(20:5w3/18:1w7) | HMDB |
| Diacylglycerol(38:6) | HMDB |
| Diglyceride | HMDB |
| Diacylglycerol(20:5n3/18:1n7) | HMDB |
| Manual Xrefs | Databases |
|---|---|
| HMDB0007565 | HMDB |
| Citations |
|---|