EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C26H48NO9P |
| Net Charge | 0 |
| Average Mass | 549.642 |
| Monoisotopic Mass | 549.30667 |
| SMILES | CCCCC/C=C\C/C=C\CCCCCCCCCC(=O)OC[C@@H](O)COP(=O)(O)OC[C@H](N)C(=O)O |
| InChI | InChI=1S/C26H48NO9P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-25(29)34-20-23(28)21-35-37(32,33)36-22-24(27)26(30)31/h6-7,9-10,23-24,28H,2-5,8,11-22,27H2,1H3,(H,30,31)(H,32,33)/b7-6-,10-9-/t23-,24+/m1/s1 |
| InChIKey | ZLBMVWNMXQYAGW-POMKQTDJSA-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(20:2(11Z,14Z)/0:0) (CHEBI:184706) is a 1-acyl-sn-glycero-3-phosphoserine (CHEBI:52603) |
| IUPAC Name |
|---|
| (2S)-2-amino-3-[hydroxy-[(2R)-2-hydroxy-3-[(11Z,14Z)-icosa-11,14-dienoyl]oxypropoxy]phosphoryl]oxypropanoic acid |
| Manual Xrefs | Databases |
|---|---|
| LMGP03050021 | LIPID MAPS |
| 113376757 | ChemSpider |