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CHEBI:185717 - PS(P-18:0/22:2(13Z,16Z))
| Formula | C46H86NO9P |
| Net Charge | 0 |
| Average Mass | 828.166 |
| Monoisotopic Mass | 827.60402 |
| SMILES | CCCCC/C=C\C/C=C\CCCCCCCCCCCC(=O)O[C@H](CO/C=C\CCCCCCCCCCCCCCCC)COP(=O)(O)OC[C@H](N)C(=O)O |
| InChI | InChI=1S/C46H86NO9P/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-26-28-30-32-34-36-38-45(48)56-43(41-54-57(51,52)55-42-44(47)46(49)50)40-53-39-37-35-33-31-29-27-25-20-18-16-14-12-10-8-6-4-2/h11,13,17,19,37,39,43-44H,3-10,12,14-16,18,20-36,38,40-42,47H2,1-2H3,(H,49,50)(H,51,52)/b13-11-,19-17-,39-37-/t43-,44+/m1/s1 |
| InChIKey | SJPGJRXTKZRWPH-DXEVVIGZSA-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) |
| PS(P-18:0/22:2(13Z,16Z)) (CHEBI:185717) is a ether lipid (CHEBI:64611) |
| PS(P-18:0/22:2(13Z,16Z)) (CHEBI:185717) is a glycerophosphoserine (CHEBI:35766) |
| IUPAC Name |
|---|
| (2S)-2-amino-3-[[(2R)-2-[(13Z,16Z)-docosa-13,16-dienoyl]oxy-3-[(Z)-octadec-1-enoxy]propoxy]-hydroxyphosphoryl]oxypropanoic acid |
| Manual Xrefs | Databases |
|---|---|
| LMGP03030054 | LIPID MAPS |
| 107450907 | ChemSpider |