EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C38H76NO7P |
| Net Charge | 0 |
| Average Mass | 690.000 |
| Monoisotopic Mass | 689.53594 |
| SMILES | CCCCCCCCCCCCCC/C=C\OC(COC(=O)CCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C |
| InChI | InChI=1S/C38H76NO7P/c1-6-8-10-12-14-16-18-19-20-22-24-26-28-30-33-43-37(36-46-47(41,42)45-34-32-39(3,4)5)35-44-38(40)31-29-27-25-23-21-17-15-13-11-9-7-2/h30,33,37H,6-29,31-32,34-36H2,1-5H3/b33-30- |
| InChIKey | JCYQQPUPIWZLSG-MEIHLTSWSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Ovis aries (ncbitaxon:9940) | Rumen (NCIT:C98778) | MetaboLights (MTBLS3683) |
| Roles Classification |
|---|
| Biological Roles: | human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). Saccharomyces cerevisiae metabolite Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| PC(14:0/P-16:0) (CHEBI:192332) is a diglyceride (CHEBI:18035) |
| IUPAC Name |
|---|
| [2-[(Z)-hexadec-1-enoxy]-3-tetradecanoyloxypropyl] 2-(trimethylazaniumyl)ethyl phosphate |
| Manual Xrefs | Databases |
|---|---|
| 24766571 | ChemSpider |
| HMDB0007895 | HMDB |