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CHEBI:70713 - cis,cis-tetradeca-5,8-dienoyl-CoA
| Formula | C35H58N7O17P3S |
| Net Charge | 0 |
| Average Mass | 973.870 |
| Monoisotopic Mass | 973.28227 |
| SMILES | CCCCC/C=C\C/C=C\CCCC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O |
| InChI | InChI=1S/C35H58N7O17P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-26(44)63-19-18-37-25(43)16-17-38-33(47)30(46)35(2,3)21-56-62(53,54)59-61(51,52)55-20-24-29(58-60(48,49)50)28(45)34(57-24)42-23-41-27-31(36)39-22-40-32(27)42/h8-9,11-12,22-24,28-30,34,45-46H,4-7,10,13-21H2,1-3H3,(H,37,43)(H,38,47)(H,51,52)(H,53,54)(H2,36,39,40)(H2,48,49,50)/b9-8-,12-11-/t24-,28-,29-,30+,34-/m1/s1 |
| InChIKey | MJBZUCVXTFUVFY-PHQNXBNMSA-N |
| Roles Classification |
|---|
| Chemical Role: | acyl donor Any donor that can transfer acyl groups between molecular entities. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| cis,cis-tetradeca-5,8-dienoyl-CoA (CHEBI:70713) is a 11,12-saturated fatty acyl-CoA (CHEBI:85348) |
| cis,cis-tetradeca-5,8-dienoyl-CoA (CHEBI:70713) is a long-chain fatty acyl-CoA (CHEBI:33184) |
| cis,cis-tetradeca-5,8-dienoyl-CoA (CHEBI:70713) is a unsaturated fatty acyl-CoA (CHEBI:51006) |
| IUPAC Name |
|---|
| 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-({3-oxo-3-[(2-{[(5Z,8Z)-tetradeca-5,8-dienoyl]sulfanyl}ethyl)amino]propyl}amino)butyl] dihydrogen diphosphate} |
| Synonyms | Source |
|---|---|
| 5-cis-8-cis-tetradecadienoyl-CoA | ChEBI |
| 5Z,8Z-tetradecadienoyl-CoA | ChEBI |
| 5Z,8Z-tetradecadienoyl-coenzyme A | ChEBI |
| cis,cis-5,8-tetradecadienoyl-CoA | ChEBI |
| cis,cis-5,8-tetradecadienoyl-coenzyme A | ChEBI |
| (cis,cis-Δ5,Δ8)-tetradecanoyl-CoA | ChEBI |
| Manual Xrefs | Databases |
|---|---|
| 28533287 | ChemSpider |
| FDB022950 | FooDB |
| HMDB0002288 | HMDB |
| LMFA07050266 | LIPID MAPS |
| Citations |
|---|