EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C50H96NO7P |
| Net Charge | 0 |
| Average Mass | 854.292 |
| Monoisotopic Mass | 853.69244 |
| SMILES | [H][C@@](CO/C=C\CCCCCC/C=C\CCCCCCCC)(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCC/C=C\CCCCCCCC |
| InChI | InChI=1S/C50H96NO7P/c1-6-8-10-12-14-16-18-20-22-24-25-26-27-28-29-31-33-35-37-39-41-43-50(52)58-49(48-57-59(53,54)56-46-44-51(3,4)5)47-55-45-42-40-38-36-34-32-30-23-21-19-17-15-13-11-9-7-2/h20-23,42,45,49H,6-19,24-41,43-44,46-48H2,1-5H3/b22-20-,23-21-,45-42-/t49-/m1/s1 |
| InChIKey | MHYVCIAEFGWAIU-SKTGCJPMSA-N |
| 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)) | ||
| urine (BTO:0001419) | PubMed (24023812) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| PC(P-18:1(9Z)/24:1(15Z)) (CHEBI:89477) is a glycerophosphocholine (CHEBI:36313) |
| Synonyms | Source |
|---|---|
| GPCho(18:1n9/24:1n9) | HMDB |
| Phosphatidylcholine(18:1n9/24:1n9) | HMDB |
| PC(18:1w9/24:1w9) | HMDB |
| Phosphatidylcholine(18:1w9/24:1w9) | HMDB |
| PC(18:1n9/24:1n9) | HMDB |
| 1-(1-Enyl-oleoyl)-2-nervonoyl-sn-glycero-3-phosphocholine | HMDB |
| Manual Xrefs | Databases |
|---|---|
| HMDB0011330 | HMDB |
| Citations |
|---|