EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C42H80NO8P |
| Net Charge | 0 |
| Average Mass | 758.075 |
| Monoisotopic Mass | 757.56216 |
| SMILES | [H][C@@](COC(=O)CCCCCCCCCCCCCC)(COP(=O)(O)OCCN)OC(=O)CCCCCCCCCCC/C=C\C/C=C\CCCCC |
| InChI | InChI=1S/C42H80NO8P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-25-27-29-31-33-35-42(45)51-40(39-50-52(46,47)49-37-36-43)38-48-41(44)34-32-30-28-26-24-16-14-12-10-8-6-4-2/h11,13,17-18,40H,3-10,12,14-16,19-39,43H2,1-2H3,(H,46,47)/b13-11-,18-17-/t40-/m1/s1 |
| InChIKey | ZHZTYDTVUSPVLX-UQZFHPPLSA-N |
| Roles Classification |
|---|
| Biological Roles: | rat metabolite Any mammalian metabolite produced during a metabolic reaction in rat (Rattus norvegicus). mouse metabolite Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| PE(15:0/22:2(13Z,16Z)) (CHEBI:156122) is a PE(15:0_22:2) (CHEBI:156121) |
| Synonyms | Source |
|---|---|
| PE 15:0/22:2(13Z,16Z) | SUBMITTER |
| 1-pentadecanoyl-2-(13Z,16Z-docosadienoyl)-glycero-3-phosphoethanolamine | SUBMITTER |
| Manual Xrefs | Databases |
|---|---|
| LMGP02010471 | LIPID MAPS |