EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C52H98O6 |
| Net Charge | 0 |
| Average Mass | 819.350 |
| Monoisotopic Mass | 818.73634 |
| SMILES | CCCC/C=C\CCCCCCCC(=O)OC[C@H](COC(=O)CCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCCCC |
| InChI | InChI=1S/C52H98O6/c1-4-7-10-13-16-19-22-24-25-26-27-28-31-34-37-40-43-46-52(55)58-49(47-56-50(53)44-41-38-35-32-29-21-18-15-12-9-6-3)48-57-51(54)45-42-39-36-33-30-23-20-17-14-11-8-5-2/h15,18,49H,4-14,16-17,19-48H2,1-3H3/b18-15-/t49-/m1/s1 |
| InChIKey | OYJCGTSOIVQMIE-FBUBQAPCSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | blood serum (BTO:0000133) | MetaboLights (MTBLS2150) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| TG(15:0/20:0/14:1(9Z)) (CHEBI:180867) is a triglyceride (CHEBI:17855) |
| IUPAC Name |
|---|
| [(2S)-1-pentadecanoyloxy-3-[(Z)-tetradec-9-enoyl]oxypropan-2-yl] icosanoate |
| Manual Xrefs | Databases |
|---|---|
| 59684003 | ChemSpider |
| HMDB0011712 | HMDB |