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CHEBI:187539 - PA(P-16:0/18:3(6Z,9Z,12Z))
| Formula | C37H67O7P |
| Net Charge | 0 |
| Average Mass | 654.910 |
| Monoisotopic Mass | 654.46244 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\CCCCC(=O)O[C@H](CO/C=C\CCCCCCCCCCCCCC)COP(=O)(O)O |
| InChI | InChI=1S/C37H67O7P/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-37(38)44-36(35-43-45(39,40)41)34-42-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h11,13,17,19,22,24,31,33,36H,3-10,12,14-16,18,20-21,23,25-30,32,34-35H2,1-2H3,(H2,39,40,41)/b13-11-,19-17-,24-22-,33-31-/t36-/m1/s1 |
| InChIKey | UKPDEGBSLCZSCQ-RMJWEJRTSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Mus musculus (ncbitaxon:10090) | feces (BTO:0000440) | MetaboLights (MTBLS3750) | Strain: C57BL/6 Mouse [NCIT:C14424] |
| Roles Classification |
|---|
| Biological Role: | mouse metabolite Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| PA(P-16:0/18:3(6Z,9Z,12Z)) (CHEBI:187539) is a monoacylglycerol phosphate (CHEBI:16961) |
| IUPAC Name |
|---|
| [(2R)-1-[(Z)-hexadec-1-enoxy]-3-phosphonooxypropan-2-yl] (6Z,9Z,12Z)-octadeca-6,9,12-trienoate |
| Manual Xrefs | Databases |
|---|---|
| 113379415 | ChemSpider |
| LMGP10030013 | LIPID MAPS |