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CHEBI:86134 - 1-octadecanoyl-2-[(6Z,9Z,12Z,15Z)-octadecatetraenoyl]-sn-glycero-3-phosphocholine
| Formula | C44H80NO8P |
| Net Charge | 0 |
| Average Mass | 782.097 |
| Monoisotopic Mass | 781.56216 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\CCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C |
| InChI | InChI=1S/C44H80NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h9,11,15,17,21,23,27,29,42H,6-8,10,12-14,16,18-20,22,24-26,28,30-41H2,1-5H3/b11-9-,17-15-,23-21-,29-27-/t42-/m1/s1 |
| InChIKey | MGIFJPVLDQAGPZ-ROBDCESFSA-N |
| Roles Classification |
|---|
| Biological Role: | human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1-octadecanoyl-2-[(6Z,9Z,12Z,15Z)-octadecatetraenoyl]-sn-glycero-3-phosphocholine (CHEBI:86134) has functional parent all-cis-octadeca-6,9,12,15-tetraenoic acid (CHEBI:32389) |
| 1-octadecanoyl-2-[(6Z,9Z,12Z,15Z)-octadecatetraenoyl]-sn-glycero-3-phosphocholine (CHEBI:86134) has functional parent octadecanoic acid (CHEBI:28842) |
| 1-octadecanoyl-2-[(6Z,9Z,12Z,15Z)-octadecatetraenoyl]-sn-glycero-3-phosphocholine (CHEBI:86134) is a phosphatidylcholine 36:4 (CHEBI:64520) |
| IUPAC Name |
|---|
| (2R)-3-(octadecanoyloxy)-2-{[(6Z,9Z,12Z,15Z)-octadeca-6,9,12,15-tetraenoyl]oxy}propyl 2-(trimethylazaniumyl)ethyl phosphate |
| Synonyms | Source |
|---|---|
| PC(18:0/18:4(6Z,9Z,12Z,15Z)) | HMDB |
| PC(18:0/18:4n3) | HMDB |
| Phosphatidylcholine(18:0/18:4w3) | HMDB |
| GPCho(18:0/18:4) | HMDB |
| GPCho(18:0/18:4n3) | HMDB |
| Phosphatidylcholine(18:0/18:4) | HMDB |
| Manual Xrefs | Databases |
|---|---|
| LMGP01010773 | LIPID MAPS |
| HMDB0008042 | HMDB |