EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C58H110O6 |
| Net Charge | 0 |
| Average Mass | 903.512 |
| Monoisotopic Mass | 902.83024 |
| SMILES | CCCCCCCC/C=C\CCCCCCCCCCCCCC(=O)O[C@@H](COC(=O)CCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCC |
| InChI | InChI=1S/C58H110O6/c1-4-7-10-13-16-19-22-25-26-27-28-29-30-31-32-34-37-40-43-46-49-52-58(61)64-55(53-62-56(59)50-47-44-41-38-35-24-21-18-15-12-9-6-3)54-63-57(60)51-48-45-42-39-36-33-23-20-17-14-11-8-5-2/h25-26,55H,4-24,27-54H2,1-3H3/b26-25-/t55-/m0/s1 |
| InChIKey | YYXNZDHKDDBRRT-WNVKVJHASA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Bos taurus (ncbitaxon:9913) | spermatozoon (BTO:0001277) | MetaboLights (MTBLS1071) | Strain: Holstein [LBO:0000132] |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| TG(15:0/24:1(15Z)/16:0) (CHEBI:184511) is a triglyceride (CHEBI:17855) |
| IUPAC Name |
|---|
| [(2S)-1-hexadecanoyloxy-3-pentadecanoyloxypropan-2-yl] (Z)-tetracos-15-enoate |
| Manual Xrefs | Databases |
|---|---|
| 59652878 | ChemSpider |
| HMDB0043367 | HMDB |