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CHEBI:171277 - PE-NMe2(20:4(5Z,8Z,11Z,14Z)/18:0)
| Formula | C45H82NO8P |
| Net Charge | 0 |
| Average Mass | 796.124 |
| Monoisotopic Mass | 795.57781 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)OCC(COP(=O)(O)OCCN(C)C)OC(=O)CCCCCCCCCCCCCCCCC |
| InChI | InChI=1S/C45H82NO8P/c1-5-7-9-11-13-15-17-19-21-22-24-25-27-29-31-33-35-37-44(47)51-41-43(42-53-55(49,50)52-40-39-46(3)4)54-45(48)38-36-34-32-30-28-26-23-20-18-16-14-12-10-8-6-2/h13,15,19,21,24-25,29,31,43H,5-12,14,16-18,20,22-23,26-28,30,32-42H2,1-4H3,(H,49,50)/b15-13-,21-19-,25-24-,31-29- |
| InChIKey | GSYSWCQMMRBABD-POCLGASTSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | |||
| NIH-3T3 cell (BTO:0000944) | MetaboLights (MTBLS78) | ||
| HeLa cell (BTO:0000567) | MetaboLights (MTBLS78) | ||
| Hepa-RG cell (BTO:0005736) | MetaboLights (MTBLS78) | ||
| HeLa cell;NIH-3T3 cell (BTO:0000944) | MetaboLights (MTBLS78) | ||
| Mus musculus (ncbitaxon:10090) | Hepa-RG cell (BTO:0005736) | MetaboLights (MTBLS78) | Strain: C57BL/6J [EFO:0000606] |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| PE-NMe2(20:4(5Z,8Z,11Z,14Z)/18:0) (CHEBI:171277) is a phosphatidylethanolamine (CHEBI:16038) |
| IUPAC Name |
|---|
| [3-[2-(dimethylamino)ethoxy-hydroxyphosphoryl]oxy-2-octadecanoyloxypropyl] (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate |
| Manual Xrefs | Databases |
|---|---|
| 74851116 | ChemSpider |
| HMDB0114329 | HMDB |