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CHEBI:86330 - 1,2-di-[(6Z)-octadecenoyl]-sn-glycero-3-phosphocholine
| Formula | C44H84NO8P |
| Net Charge | 0 |
| Average Mass | 786.129 |
| Monoisotopic Mass | 785.59346 |
| SMILES | CCCCCCCCCCC/C=C\CCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCC/C=C\CCCCCCCCCCC |
| InChI | InChI=1S/C44H84NO8P/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/h26-29,42H,6-25,30-41H2,1-5H3/b28-26-,29-27-/t42-/m1/s1 |
| InChIKey | KLJBLQFSKZACGJ-MMKOEKFTSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | |||
| - | PubMed (25502724) | ||
| - | MetaboLights (MTBLS93) | ||
| - | MetaboLights (MTBLS90) | ||
| - | MetaboLights (MTBLS124) |
| Roles Classification |
|---|
| Biological Roles: | human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). mouse metabolite Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus). metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. 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) |
| 1,2-di-[(6Z)-octadecenoyl]-sn-glycero-3-phosphocholine (CHEBI:86330) has functional parent petroselinic acid (CHEBI:28194) |
| 1,2-di-[(6Z)-octadecenoyl]-sn-glycero-3-phosphocholine (CHEBI:86330) has role human metabolite (CHEBI:77746) |
| 1,2-di-[(6Z)-octadecenoyl]-sn-glycero-3-phosphocholine (CHEBI:86330) is a 1,2-di-octadecenoyl-sn-glycero-3-phosphocholine (CHEBI:84836) |
| IUPAC Name |
|---|
| (2R)-2,3-bis{[(6Z)-octadec-6-enoyl]oxy}propyl 2-(trimethylazaniumyl)ethyl phosphate |
| Synonym | Source |
|---|---|
| 1,2-dipetroselenoyl-sn-glycero-3-phosphocholine | ChEBI |
| Manual Xrefs | Databases |
|---|---|
| LMGP01010868 | LIPID MAPS |
| Citations |
|---|