EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C46H88NO9P |
| Net Charge | 0 |
| Average Mass | 830.182 |
| Monoisotopic Mass | 829.61967 |
| SMILES | CCCCC/C=C\C/C=C\CCCCCCCCCC(=O)O[C@H](COCCCCCCCCCCCCCCCCCCCC)COP(=O)(O)OC[C@H](N)C(=O)O |
| InChI | InChI=1S/C46H88NO9P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-53-40-43(41-54-57(51,52)55-42-44(47)46(49)50)56-45(48)38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h12,14,18,20,43-44H,3-11,13,15-17,19,21-42,47H2,1-2H3,(H,49,50)(H,51,52)/b14-12-,20-18-/t43-,44+/m1/s1 |
| InChIKey | PWVUGXXQAYIAQE-MJPIINLISA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Mus musculus (ncbitaxon:10090) | serum (BTO:0001239) | MetaboLights (MTBLS3725) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| PS(O-20:0/20:2(11Z,14Z)) (CHEBI:184230) is a ether lipid (CHEBI:64611) |
| PS(O-20:0/20:2(11Z,14Z)) (CHEBI:184230) is a glycerophosphoserine (CHEBI:35766) |
| IUPAC Name |
|---|
| (2S)-2-amino-3-[hydroxy-[(2R)-2-[(11Z,14Z)-icosa-11,14-dienoyl]oxy-3-icosoxypropoxy]phosphoryl]oxypropanoic acid |
| Manual Xrefs | Databases |
|---|---|
| 113376627 | ChemSpider |
| LMGP03020061 | LIPID MAPS |