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CHEBI:166785 - cholest-5-en-3β-yl (13Z,16Z-docosadienoate)
| Formula | C49H84O2 |
| Net Charge | 0 |
| Average Mass | 705.209 |
| Monoisotopic Mass | 704.64713 |
| SMILES | [H][C@@]12CC=C3C[C@@H](OC(=O)CCCCCCCCCCC/C=C\C/C=C\CCCCC)CC[C@]3(C)[C@@]1([H])CC[C@@]1(C)[C@@]2([H])CC[C@]1([H])[C@H](C)CCCC(C)C |
| InChI | InChI=1S/C49H84O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-29-47(50)51-42-34-36-48(5)41(38-42)30-31-43-45-33-32-44(40(4)28-26-27-39(2)3)49(45,6)37-35-46(43)48/h11-12,14-15,30,39-40,42-46H,7-10,13,16-29,31-38H2,1-6H3/b12-11-,15-14-/t40-,42+,43+,44-,45+,46+,48+,49-/m1/s1 |
| InChIKey | YSGVSTJGBYXXIM-GFMQGYSGSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| cholest-5-en-3β-yl (13Z,16Z-docosadienoate) (CHEBI:166785) is a CE(22:2) (CHEBI:183801) |
| IUPAC Name |
|---|
| cholest-5-en-3β-yl (13Z,16Z)-docosa-13,16-dienoate |
| Synonyms | Source |
|---|---|
| CE(22:2(13Z,16Z)) | ChEBI |
| cholesteryl (13Z,16Z-docosadienoate) | ChEBI |
| cholesteryl ester (22:2(13Z,16Z)) | ChEBI |
| Manual Xrefs | Databases |
|---|---|
| HMDB0006737 | HMDB |
| LMST01020017 | LIPID MAPS |
| 17221004 | ChemSpider |
| CPD-21817 | MetaCyc |
| Citations |
|---|