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CHEBI:188413 - PE(22:5(7Z,10Z,13Z,16Z,19Z)/20:1(11Z))
| Formula | C47H82NO8P |
| Net Charge | 0 |
| Average Mass | 820.146 |
| Monoisotopic Mass | 819.57781 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCC(=O)OC[C@H](COP(=O)(O)OCCN)OC(=O)CCCCCCCCC/C=C\CCCCCCCC |
| InChI | InChI=1S/C47H82NO8P/c1-3-5-7-9-11-13-15-17-19-21-22-24-25-27-29-31-33-35-37-39-46(49)53-43-45(44-55-57(51,52)54-42-41-48)56-47(50)40-38-36-34-32-30-28-26-23-20-18-16-14-12-10-8-6-4-2/h5,7,11,13,17-20,22,24,27,29,45H,3-4,6,8-10,12,14-16,21,23,25-26,28,30-44,48H2,1-2H3,(H,51,52)/b7-5-,13-11-,19-17-,20-18-,24-22-,29-27-/t45-/m1/s1 |
| InChIKey | XLYAEBCMTCDSEA-NIVNKCBGSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Mus musculus (ncbitaxon:10090) | blood serum (BTO:0000133) | MetaboLights (MTBLS3886) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| PE(22:5(7Z,10Z,13Z,16Z,19Z)/20:1(11Z)) (CHEBI:188413) is a 1,2-diacyl-sn-glycero-3-phosphoethanolamine (CHEBI:64674) |
| IUPAC Name |
|---|
| [(2R)-3-[2-aminoethoxy(hydroxy)phosphoryl]oxy-2-[(Z)-icos-11-enoyl]oxypropyl] (7Z,10Z,13Z,16Z,19Z)-docosa-7,10,13,16,19-pentaenoate |
| Manual Xrefs | Databases |
|---|---|
| 24769103 | ChemSpider |
| HMDB0009659 | HMDB |