EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C42H78NO7P |
| Net Charge | 0 |
| Average Mass | 740.060 |
| Monoisotopic Mass | 739.55159 |
| SMILES | [H][C@@](CO/C=C\CCCCCCCCCCCCCC)(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC |
| InChI | InChI=1S/C42H78NO7P/c1-6-8-10-12-14-16-18-20-22-23-25-27-29-31-33-35-42(44)50-41(40-49-51(45,46)48-38-36-43(3,4)5)39-47-37-34-32-30-28-26-24-21-19-17-15-13-11-9-7-2/h8,10,14,16,20,22,34,37,41H,6-7,9,11-13,15,17-19,21,23-33,35-36,38-40H2,1-5H3/b10-8-,16-14-,22-20-,37-34-/t41-/m1/s1 |
| InChIKey | WXQJKOUXCWEMOK-LUPMRSKMSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | |||
| urine (BTO:0001419) | PubMed (24023812) | ||
| saliva (UBERON:0001836) | Article (Dame, ZT. et al. (2014) The Human Saliva Metabolome (manuscript in preparation)) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| PC(P-16:0/18:3(9Z,12Z,15Z)) (CHEBI:89978) is a glycerophosphocholine (CHEBI:36313) |
| Synonyms | Source |
|---|---|
| Phosphatidylcholine(16:0/18:3w3) | HMDB |
| PC(16:0/18:3) | HMDB |
| PC aa C34:3 | HMDB |
| Phosphatidylcholine(34:3) | HMDB |
| GPCho(16:0/18:3n3) | HMDB |
| (2-{[(2R)-3-[(1Z)-hexadec-1-en-1-yloxy]-2-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyloxy]propyl phosphonato]oxy}ethyl)trimethylazanium | HMDB |
| Manual Xrefs | Databases |
|---|---|
| HMDB0011213 | HMDB |
| Citations |
|---|