EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C44H87NO2 |
| Net Charge | 0 |
| Average Mass | 662.185 |
| Monoisotopic Mass | 661.67368 |
| SMILES | CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](C)NC(=O)CCCCCCCCCCCCCCCCCCCCCCCCC |
| InChI | InChI=1S/C44H87NO2/c1-4-6-8-10-12-14-16-18-19-20-21-22-23-24-25-26-27-29-31-33-35-37-39-41-44(47)45-42(3)43(46)40-38-36-34-32-30-28-17-15-13-11-9-7-5-2/h38,40,42-43,46H,4-37,39,41H2,1-3H3,(H,45,47)/b40-38+/t42-,43+/m0/s1 |
| InChIKey | HIPRQCXVSRJDCK-IHGDIBJZSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Mus musculus (ncbitaxon:10090) | feces (BTO:0000440) | MetaboLights (MTBLS3750) | Strain: C57BL/6 Mouse [NCIT:C14424] |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Cer(m18:1(4E)/26:0) (CHEBI:187787) is a fatty amide (CHEBI:29348) |
| IUPAC Name |
|---|
| N-[(E,2S,3R)-3-hydroxyoctadec-4-en-2-yl]hexacosanamide |
| Manual Xrefs | Databases |
|---|---|
| LMSP00000009 | LIPID MAPS |
| 113381076 | ChemSpider |