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CHEBI:187642 - PE(20:4(5Z,8Z,11Z,14Z)/18:2(9Z,12Z))
| Formula | C43H74NO8P |
| Net Charge | 0 |
| Average Mass | 764.038 |
| Monoisotopic Mass | 763.51520 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)OC[C@H](COP(=O)(O)OCCN)OC(=O)CCCCCCC/C=C\C/C=C\CCCCC |
| InChI | InChI=1S/C43H74NO8P/c1-3-5-7-9-11-13-15-17-19-20-22-23-25-27-29-31-33-35-42(45)49-39-41(40-51-53(47,48)50-38-37-44)52-43(46)36-34-32-30-28-26-24-21-18-16-14-12-10-8-6-4-2/h11-14,17-19,21-23,27,29,41H,3-10,15-16,20,24-26,28,30-40,44H2,1-2H3,(H,47,48)/b13-11-,14-12-,19-17-,21-18-,23-22-,29-27-/t41-/m1/s1 |
| InChIKey | VRBJSZDBPQLNEM-PFTGJCAASA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Mus musculus (ncbitaxon:10090) | feces (BTO:0000440) | MetaboLights (MTBLS3750) | Strain: C57BL/6 Mouse [NCIT:C14424] |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| PE(20:4(5Z,8Z,11Z,14Z)/18:2(9Z,12Z)) (CHEBI:187642) is a 1,2-diacyl-sn-glycero-3-phosphoethanolamine (CHEBI:64674) |
| IUPAC Name |
|---|
| [(2R)-3-[2-aminoethoxy(hydroxy)phosphoryl]oxy-2-[(9Z,12Z)-octadeca-9,12-dienoyl]oxypropyl] (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate |
| Manual Xrefs | Databases |
|---|---|
| HMDB0009390 | HMDB |
| LMGP02010945 | LIPID MAPS |
| 24768841 | ChemSpider |