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| Formula | C55H90O6 |
| Net Charge | 0 |
| Average Mass | 847.319 |
| Monoisotopic Mass | 846.67374 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\CCCCC(=O)OC[C@H](COC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC)OC(=O)CCCCCCC/C=C\CCCCCC |
| InChI | InChI=1S/C55H90O6/c1-4-7-10-13-16-19-22-25-27-30-32-35-38-41-44-47-53(56)59-50-52(61-55(58)49-46-43-40-37-34-29-24-21-18-15-12-9-6-3)51-60-54(57)48-45-42-39-36-33-31-28-26-23-20-17-14-11-8-5-2/h7-8,10-11,16-17,19-21,24-28,32,35,52H,4-6,9,12-15,18,22-23,29-31,33-34,36-51H2,1-3H3/b10-7-,11-8-,19-16-,20-17-,24-21-,27-25-,28-26-,35-32-/t52-/m1/s1 |
| InChIKey | VTUCRMTUBJPSND-BWOWEGOZSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| TG(18:3(9Z,12Z,15Z)/16:1(9Z)/18:4(6Z,9Z,12Z,15Z)) (CHEBI:196913) is a triglyceride (CHEBI:17855) |
| IUPAC Name |
|---|
| [(2S)-2-[(Z)-hexadec-9-enoyl]oxy-3-[(6Z,9Z,12Z,15Z)-octadeca-6,9,12,15-tetraenoyl]oxypropyl] (9Z,12Z,15Z)-octadeca-9,12,15-trienoate |
| Manual Xrefs | Databases |
|---|---|
| 59663746 | ChemSpider |
| HMDB0055205 | HMDB |