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CHEBI:172860 - PIP(16:0/20:2(11Z,14Z))
| Formula | C45H84O16P2 |
| Net Charge | 0 |
| Average Mass | 943.099 |
| Monoisotopic Mass | 942.52346 |
| SMILES | CCCCC/C=C\C/C=C\CCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCC)COP(=O)(O)O[C@H]1C(O)C(O)C(O)[C@@H](OP(=O)(O)O)C1O |
| InChI | InChI=1S/C45H84O16P2/c1-3-5-7-9-11-13-15-17-18-19-20-22-24-26-28-30-32-34-39(47)59-37(35-57-38(46)33-31-29-27-25-23-21-16-14-12-10-8-6-4-2)36-58-63(55,56)61-45-42(50)40(48)41(49)44(43(45)51)60-62(52,53)54/h11,13,17-18,37,40-45,48-51H,3-10,12,14-16,19-36H2,1-2H3,(H,55,56)(H2,52,53,54)/b13-11-,18-17-/t37-,40?,41?,42?,43?,44-,45+/m1/s1 |
| InChIKey | PDGYWIUVBBIOKN-ZVASIDSISA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | blood plasma (BTO:0000131) | MetaboLights (MTBLS2633) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| PIP(16:0/20:2(11Z,14Z)) (CHEBI:172860) is a glycerophosphoinositol phosphate (CHEBI:35771) |
| IUPAC Name |
|---|
| [(2R)-1-hexadecanoyloxy-3-[hydroxy-[(1S,5R)-2,3,4,6-tetrahydroxy-5-phosphonooxycyclohexyl]oxyphosphoryl]oxypropan-2-yl] (11Z,14Z)-icosa-11,14-dienoate |
| Manual Xrefs | Databases |
|---|---|
| C00626 | KEGG COMPOUND |
| HMDB0009928 | HMDB |
| 24767810 | ChemSpider |