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CHEBI:230727 - p-isopge2-pc
| Formula | C44H80NO11P |
| Net Charge | 0 |
| Average Mass | 830.094 |
| Monoisotopic Mass | 829.54690 |
| SMILES | CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCC/C=C\CC1C(=O)CC(O)C1/C=C/C(O)CCCCC |
| InChI | InChI=1S/C44H80NO11P/c1-6-8-10-11-12-13-14-15-16-17-18-19-24-28-43(49)53-35-38(36-55-57(51,52)54-33-32-45(3,4)5)56-44(50)29-25-21-20-23-27-39-40(42(48)34-41(39)47)31-30-37(46)26-22-9-7-2/h20,23,30-31,37-40,42,46,48H,6-19,21-22,24-29,32-36H2,1-5H3/b23-20-,31-30+/t37?,38-,39?,40?,42?/m1/s1 |
| InChIKey | RBCIEFVODSDAEH-ZRLPZGMBSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | feces (BTO:0000440) | MetaboLights (MTBLS9087) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| p-isopge2-pc (CHEBI:230727) is a organic molecular entity (CHEBI:50860) |
| IUPAC Name |
|---|
| [(2R)-3-hexadecanoyloxy-2-[(Z)-7-[3-hydroxy-2-[(E)-3-hydroxyoct-1-enyl]-5-oxocyclopentyl]hept-5-enoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate |
| Manual Xrefs | Databases |
|---|---|
| LMGP20010043 | LIPID MAPS |