EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C43H80NO8P |
| Net Charge | 0 |
| Average Mass | 770.086 |
| Monoisotopic Mass | 769.56216 |
| SMILES | [H][C@@](COC(=O)CCCCCCCCCCCCCC)(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCC/C=C\C/C=C\C/C=C\CCCCCCCC |
| InChI | InChI=1S/C43H80NO8P/c1-6-8-10-12-14-16-18-20-21-22-23-24-26-28-30-32-34-36-43(46)52-41(40-51-53(47,48)50-38-37-44(3,4)5)39-49-42(45)35-33-31-29-27-25-19-17-15-13-11-9-7-2/h20-21,23-24,28,30,41H,6-19,22,25-27,29,31-40H2,1-5H3/b21-20-,24-23-,30-28-/t41-/m1/s1 |
| InChIKey | HPSXRQYORYXLNT-WPCOGVEASA-N |
| Roles Classification |
|---|
| Biological Role: | human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| PC(15:0/20:3(5Z,8Z,11Z)) (CHEBI:137279) is a phosphatidylcholine 35:3 (CHEBI:131439) |
| Synonym | Source |
|---|---|
| 1-pentadecanoyl-2-(5Z,8Z,11Z-eicosatrienoyl)-sn-glycero-3-phosphocholine | ChEBI |
| Manual Xrefs | Databases |
|---|---|
| HMDB0007947 | HMDB |