EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C44H78NO7P |
| Net Charge | 0 |
| Average Mass | 764.082 |
| Monoisotopic Mass | 763.55159 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\CCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)O/C=C\CCCCCC/C=C\CCCCCCCC |
| InChI | InChI=1S/C44H78NO7P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-39-49-43(42-52-53(47,48)51-40-38-45(3,4)5)41-50-44(46)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h9,11,15,17,20-23,27,29,36,39,43H,6-8,10,12-14,16,18-19,24-26,28,30-35,37-38,40-42H2,1-5H3/b11-9-,17-15-,22-20-,23-21-,29-27-,39-36- |
| InChIKey | KRKGEBPORBUETM-JJJJCJMPSA-N |
| Wikipedia |
|---|
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | saliva (UBERON:0001836) | Article (Dame, ZT. et al. (2014) The Human Saliva Metabolome (manuscript in preparation)) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| PC(18:4(6Z,9Z,12Z,15Z)/P-18:1(9Z)) (CHEBI:89356) is a glycerophosphocholine (CHEBI:36313) |
| Synonyms | Source |
|---|---|
| Phosphatidylcholine(18:4/18:1) | HMDB |
| trimethyl[2-({2-[(1Z,9Z)-octadeca-1,9-dien-1-yloxy]-3-[(6Z,9Z,12Z,15Z)-octadeca-6,9,12,15-tetraenoyloxy]propyl phosphonato}oxy)ethyl]azanium | HMDB |
| GPCho(36:5) | HMDB |
| Phosphatidylcholine(18:4w3/18:1w9) | HMDB |
| PC aa C36:5 | HMDB |
| Phosphatidylcholine(36:5) | HMDB |
| Manual Xrefs | Databases |
|---|---|
| PHOSPHATIDYLCHOLINE | MetaCyc |
| HMDB0008261 | HMDB |
| Lecithin | Wikipedia |