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CHEBI:86176 - 1-octadecanoyl-2-[(5Z,8Z,11Z)-eicosatrienoyl]-sn-glycero-3-phosphocholine
| Formula | C46H86NO8P |
| Net Charge | 0 |
| Average Mass | 812.167 |
| Monoisotopic Mass | 811.60911 |
| SMILES | CCCCCCCC/C=C\C/C=C\C/C=C\CCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C |
| InChI | InChI=1S/C46H86NO8P/c1-6-8-10-12-14-16-18-20-22-23-25-27-29-31-33-35-37-39-46(49)55-44(43-54-56(50,51)53-41-40-47(3,4)5)42-52-45(48)38-36-34-32-30-28-26-24-21-19-17-15-13-11-9-7-2/h20,22,25,27,31,33,44H,6-19,21,23-24,26,28-30,32,34-43H2,1-5H3/b22-20-,27-25-,33-31-/t44-/m1/s1 |
| InChIKey | QXDDDGCNWRUEFM-UMKMFDOBSA-N |
| Roles Classification |
|---|
| Biological Role: | metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1-octadecanoyl-2-[(5Z,8Z,11Z)-eicosatrienoyl]-sn-glycero-3-phosphocholine (CHEBI:86176) has functional parent (5Z,8Z,11Z)-icosatrienoic acid (CHEBI:72865) |
| 1-octadecanoyl-2-[(5Z,8Z,11Z)-eicosatrienoyl]-sn-glycero-3-phosphocholine (CHEBI:86176) has functional parent octadecanoic acid (CHEBI:28842) |
| 1-octadecanoyl-2-[(5Z,8Z,11Z)-eicosatrienoyl]-sn-glycero-3-phosphocholine (CHEBI:86176) is a 1-stearoyl-2-icosatrienoyl-sn-glycero-3-phosphocholine (CHEBI:133633) |
| Synonyms | Source |
|---|---|
| PC(18:0/20:3(5Z,8Z,11Z)) | LIPID MAPS |
| PC(18:0/20:3w9) | HMDB |
| GPCho(18:0/20:3) | HMDB |
| GPCho(18:0/20:3n9) | HMDB |
| Phosphatidylcholine(18:0/20:3) | HMDB |
| Phosphatidylcholine(18:0/20:3w9) | HMDB |
| Manual Xrefs | Databases |
|---|---|
| LMGP01010796 | LIPID MAPS |
| HMDB0008046 | HMDB |
| Citations |
|---|