EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C51H88O6 |
| Net Charge | 0 |
| Average Mass | 797.259 |
| Monoisotopic Mass | 796.65809 |
| SMILES | CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@@H](COC(=O)CCCCCCC/C=C\CCCC)OC(=O)CCCCCCC/C=C\CCCCCC |
| InChI | InChI=1S/C51H88O6/c1-4-7-10-13-16-19-22-24-25-27-29-32-35-38-41-44-50(53)56-47-48(46-55-49(52)43-40-37-34-31-28-21-18-15-12-9-6-3)57-51(54)45-42-39-36-33-30-26-23-20-17-14-11-8-5-2/h7,10,15-16,18-20,23-25,48H,4-6,8-9,11-14,17,21-22,26-47H2,1-3H3/b10-7-,18-15-,19-16-,23-20-,25-24-/t48-/m1/s1 |
| InChIKey | ZFCWRLVKQZYVPK-PHRGGPMISA-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(14:1(9Z)/16:1(9Z)/18:3(9Z,12Z,15Z)) (CHEBI:184561) is a triglyceride (CHEBI:17855) |
| IUPAC Name |
|---|
| [(2R)-2-[(Z)-hexadec-9-enoyl]oxy-3-[(Z)-tetradec-9-enoyl]oxypropyl] (9Z,12Z,15Z)-octadeca-9,12,15-trienoate |
| Manual Xrefs | Databases |
|---|---|
| 113372885 | ChemSpider |
| LMGL03014660 | LIPID MAPS |