EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C42H84NO7P |
| Net Charge | 0 |
| Average Mass | 746.108 |
| Monoisotopic Mass | 745.59854 |
| SMILES | [H][C@@](COCCCCCCCCCC/C=C\CCCCCC)(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCC |
| InChI | InChI=1S/C42H84NO7P/c1-6-8-10-12-14-16-18-20-21-22-24-26-28-30-32-34-37-47-39-41(40-49-51(45,46)48-38-36-43(3,4)5)50-42(44)35-33-31-29-27-25-23-19-17-15-13-11-9-7-2/h16,18,41H,6-15,17,19-40H2,1-5H3/b18-16-/t41-/m1/s1 |
| InChIKey | QCGUXAIDEOWPBV-SNKLRXETSA-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(o-18:1(11Z)/16:0) (CHEBI:89880) is a glycerophosphocholine (CHEBI:36313) |
| Synonyms | Source |
|---|---|
| Phosphatidylcholine(18:1n7/16:0) | HMDB |
| PC(34:1) | HMDB |
| Phosphatidylcholine(18:1w7/16:0) | HMDB |
| Lecithin | HMDB |
| PC(O-34:1) | HMDB |
| (2-{[(2R)-2-(hexadecanoyloxy)-3-[(11Z)-octadec-11-en-1-yloxy]propyl phosphonato]oxy}ethyl)trimethylazanium | HMDB |
| Manual Xrefs | Databases |
|---|---|
| HMDB0013424 | HMDB |
| Citations |
|---|