EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C43H77O13P |
| Net Charge | 0 |
| Average Mass | 833.050 |
| Monoisotopic Mass | 832.51018 |
| SMILES | CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCC)COP(=O)(O)OC1C(O)C(O)C(O)[C@@H](O)C1O |
| InChI | InChI=1S/C43H77O13P/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-37(45)55-35(34-54-57(51,52)56-43-41(49)39(47)38(46)40(48)42(43)50)33-53-36(44)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h5,7,11,13,17-18,35,38-43,46-50H,3-4,6,8-10,12,14-16,19-34H2,1-2H3,(H,51,52)/b7-5-,13-11-,18-17-/t35-,38?,39-,40?,41?,42?,43?/m1/s1 |
| InChIKey | UHAJRYVOXHROHT-TYCYVUFNSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Canis lupus (ncbitaxon:9612) | liver (BTO:0000759) | MetaboLights (MTBLS4015) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| PI(16:1/18:2) (CHEBI:190207) is a phosphatidylinositol (CHEBI:28874) |
| IUPAC Name |
|---|
| [(2R)-1-hexadecanoyloxy-3-[hydroxy-[(5R)-2,3,4,5,6-pentahydroxycyclohexyl]oxyphosphoryl]oxypropan-2-yl] (9Z,12Z,15Z)-octadeca-9,12,15-trienoate |
| Manual Xrefs | Databases |
|---|---|
| LMGP06010944 | LIPID MAPS |