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CHEBI:176772 - PI(17:0/20:4)
| Formula | C46H81O13P |
| Net Charge | 0 |
| Average Mass | 873.115 |
| Monoisotopic Mass | 872.54148 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCCC)COP(=O)(O)OC1C(O)C(O)C(O)[C@@H](O)C1O |
| InChI | InChI=1S/C46H81O13P/c1-3-5-7-9-11-13-15-17-19-20-21-23-25-27-29-31-33-35-40(48)58-38(37-57-60(54,55)59-46-44(52)42(50)41(49)43(51)45(46)53)36-56-39(47)34-32-30-28-26-24-22-18-16-14-12-10-8-6-4-2/h11,13,17,19,21,23,27,29,38,41-46,49-53H,3-10,12,14-16,18,20,22,24-26,28,30-37H2,1-2H3,(H,54,55)/b13-11-,19-17-,23-21-,29-27-/t38-,41?,42-,43?,44?,45?,46?/m1/s1 |
| InChIKey | IVKFRZJXXGDYJH-YAOSNULYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | |||
| blood plasma (BTO:0000118) | MetaboLights (MTBLS2262) | ||
| blood plasma (BTO:0000118) | MetaboLights (MTBLS2262) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| PI(17:0/20:4) (CHEBI:176772) is a phosphatidylinositol 37:4 (CHEBI:190530) |
| IUPAC Name |
|---|
| [(2R)-1-heptadecanoyloxy-3-[hydroxy-[(5R)-2,3,4,5,6-pentahydroxycyclohexyl]oxyphosphoryl]oxypropan-2-yl] (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate |
| Manual Xrefs | Databases |
|---|---|
| LMGP06010004 | LIPID MAPS |
| 7826091 | ChemSpider |