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| Formula | C43H82NO10P |
| Net Charge | 0 |
| Average Mass | 804.100 |
| Monoisotopic Mass | 803.56763 |
| SMILES | CCCCCCCC/C=C\CCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCC)COP(=O)(O)OC[C@H](N)C(=O)O |
| InChI | InChI=1S/C43H82NO10P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-25-27-29-31-33-35-42(46)54-39(37-52-55(49,50)53-38-40(44)43(47)48)36-51-41(45)34-32-30-28-26-24-16-14-12-10-8-6-4-2/h17-18,39-40H,3-16,19-38,44H2,1-2H3,(H,47,48)(H,49,50)/b18-17-/t39-,40+/m1/s1 |
| InChIKey | CMYXIUIAXHLISA-WMWCSSQDSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Macaca fascicularis (ncbitaxon:9541) | blood plasma (BTO:0000131) | MetaboLights (MTBLS5005) |
| Roles Classification |
|---|
| Chemical Roles: | Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid). Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid). |
| Biological Role: | human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| PS(15:0/22:1(13Z)) (CHEBI:194570) is a phosphatidyl-L-serine (CHEBI:18303) |
| IUPAC Name |
|---|
| (2S)-2-amino-3-[[(2R)-2-[(Z)-docos-13-enoyl]oxy-3-pentadecanoyloxypropoxy]-hydroxyphosphoryl]oxypropanoic acid |
| Manual Xrefs | Databases |
|---|---|
| 74875780 | ChemSpider |