EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C38H68O4 |
| Net Charge | 0 |
| Average Mass | 588.958 |
| Monoisotopic Mass | 588.51176 |
| SMILES | CC/C=C\C/C=C\[C@@H](/C=C\CCCCCCCC(=O)O)OC(=O)CCCCCCCCCCCCCCCCCCC |
| InChI | InChI=1S/C38H68O4/c1-3-5-7-9-10-11-12-13-14-15-16-17-18-19-23-27-31-35-38(41)42-36(32-28-24-8-6-4-2)33-29-25-21-20-22-26-30-34-37(39)40/h6,8,28-29,32-33,36H,3-5,7,9-27,30-31,34-35H2,1-2H3,(H,39,40)/b8-6-,32-28-,33-29-/t36-/m0/s1 |
| InChIKey | TWSDQPAKNQMSSC-QXDCLJFISA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Nitrosopumilus maritimus str. SCM1 (ncbitaxon:436308) | cell culture (BTO:0000214) | MetaboLights (MTBLS3714) |
| Roles Classification |
|---|
| Chemical Role: | Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Mayolene-20 (CHEBI:186572) is a FAHFA (CHEBI:84426) |
| IUPAC Name |
|---|
| (9Z,11R,12Z,15Z)-11-icosanoyloxyoctadeca-9,12,15-trienoic acid |
| Manual Xrefs | Databases |
|---|---|
| LMFA07010691 | LIPID MAPS |
| 113371110 | ChemSpider |