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| Formula | C36H60O6 |
| Net Charge | 0 |
| Average Mass | 588.870 |
| Monoisotopic Mass | 588.43899 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C=C\C(O)CCCC(=O)O[C@@H](CO)COC(=O)CCCCCCCCCCCC |
| InChI | InChI=1S/C36H60O6/c1-3-5-7-9-11-13-15-16-17-18-20-22-24-27-33(38)28-26-30-36(40)42-34(31-37)32-41-35(39)29-25-23-21-19-14-12-10-8-6-4-2/h5,7,11,13,16-17,20,22,24,27,33-34,37-38H,3-4,6,8-10,12,14-15,18-19,21,23,25-26,28-32H2,1-2H3/b7-5-,13-11-,17-16-,22-20-,27-24+/t33?,34-/m0/s1 |
| InChIKey | VMWPUPZXTYJBRV-BOFINSKGSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Mus musculus (ncbitaxon:10090) | feces (BTO:0000440) | MetaboLights (MTBLS9100) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| DG(13:0/20:5(6E,8Z,11Z,14Z,17Z)-OH(5)/0:0) (CHEBI:230361) is a organic molecular entity (CHEBI:50860) |
| IUPAC Name |
|---|
| [(2S)-1-hydroxy-3-tridecanoyloxypropan-2-yl] (6E,8Z,11Z,14Z,17Z)-5-hydroxyicosa-6,8,11,14,17-pentaenoate |
| Manual Xrefs | Databases |
|---|---|
| 117214156 | ChemSpider |
| HMDB0294953 | HMDB |