EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C48H88NO8P |
| Net Charge | 0 |
| Average Mass | 838.205 |
| Monoisotopic Mass | 837.62476 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\CCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCC/C=C\CCCCCCCC |
| InChI | InChI=1S/C48H88NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-38-40-47(50)54-44-46(45-56-58(52,53)55-43-42-49(3,4)5)57-48(51)41-39-37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h14,16,20-23,26,28,46H,6-13,15,17-19,24-25,27,29-45H2,1-5H3/b16-14-,22-20-,23-21-,28-26-/t46-/m1/s1 |
| InChIKey | LZXZOHSYOCWXFB-DWTYVZKUSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | Serum (BTO:0000133) | MetaboLights (MTBLS4478) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| PC(20:3(8Z,11Z,14Z)/20:1(11Z)) (CHEBI:190157) is a 1,2-diacyl-sn-glycero-3-phosphocholine (CHEBI:57643) |
| IUPAC Name |
|---|
| [(2R)-3-[(8Z,11Z,14Z)-icosa-8,11,14-trienoyl]oxy-2-[(Z)-icos-11-enoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate |
| Manual Xrefs | Databases |
|---|---|
| HMDB0011201 | HMDB |
| 24767067 | ChemSpider |
| LMGP01011886 | LIPID MAPS |