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| Formula | C58H102O6 |
| Net Charge | 0 |
| Average Mass | 895.448 |
| Monoisotopic Mass | 894.76764 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)OC[C@@H](COC(=O)CCCCCCCCCCCCCC)OC(=O)CCCCCCCCC/C=C\CCCCCCCC |
| InChI | InChI=1S/C58H102O6/c1-4-7-10-13-16-19-22-25-27-29-31-33-36-39-42-45-48-51-57(60)63-54-55(53-62-56(59)50-47-44-41-38-35-24-21-18-15-12-9-6-3)64-58(61)52-49-46-43-40-37-34-32-30-28-26-23-20-17-14-11-8-5-2/h16,19,25-28,31,33,39,42,55H,4-15,17-18,20-24,29-30,32,34-38,40-41,43-54H2,1-3H3/b19-16-,27-25-,28-26-,33-31-,42-39-/t55-/m1/s1 |
| InChIKey | JDZRSDCYLJXRKY-HPGVEKDJSA-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(15:0/20:1(11Z)/20:4(5Z,8Z,11Z,14Z)) (CHEBI:185175) is a triglyceride (CHEBI:17855) |
| IUPAC Name |
|---|
| [(2R)-1-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyl]oxy-3-pentadecanoyloxypropan-2-yl] (Z)-icos-11-enoate |
| Manual Xrefs | Databases |
|---|---|
| LMGL03015280 | LIPID MAPS |
| 113373312 | ChemSpider |