EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C42H82NO8P |
| Net Charge | 0 |
| Average Mass | 760.091 |
| Monoisotopic Mass | 759.57781 |
| SMILES | CCCCCCCCC/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C |
| InChI | InChI=1S/C42H82NO8P/c1-6-8-10-12-14-16-18-20-21-22-23-25-27-29-31-33-35-42(45)51-40(39-50-52(46,47)49-37-36-43(3,4)5)38-48-41(44)34-32-30-28-26-24-19-17-15-13-11-9-7-2/h21-22,40H,6-20,23-39H2,1-5H3/b22-21-/t40-/m1/s1 |
| InChIKey | XOFXLHDPMXNPOR-ZBCYVRFFSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| PC(15:0/19:1(9Z)) (CHEBI:178452) is a 1,2-diacyl-sn-glycero-3-phosphocholine (CHEBI:57643) |
| IUPAC Name |
|---|
| [(2R)-2-[(Z)-nonadec-9-enoyl]oxy-3-pentadecanoyloxypropyl] 2-(trimethylazaniumyl)ethyl phosphate |
| Manual Xrefs | Databases |
|---|---|
| LMGP01011419 | LIPID MAPS |