CHEBI:52966 - hexacosanoyl-CoA

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ChEBI Name hexacosanoyl-CoA
ChEBI ID CHEBI:52966
Definition A very long-chain fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of hexacosanoic (cerotic) acid..
Stars This entity has been manually annotated by the ChEBI Team.
Submitter kieran
Supplier Information No supplier information found for this compound.
Download Molfile XML SDF
Formula C47H86N7O17P3S
Net Charge 0
Average Mass 1146.20900
Monoisotopic Mass 1145.50138
InChI InChI=1S/C47H86N7O17P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-38(56)75-31-30-49-37(55)28-29-50-45(59)42(58)47(2,3)33-68-74(65,66)71-73(63,64)67-32-36-41(70-72(60,61)62)40(57)46(69-36)54-35-53-39-43(48)51-34-52-44(39)54/h34-36,40-42,46,57-58H,4-33H2,1-3H3,(H,49,55)(H,50,59)(H,63,64)(H,65,66)(H2,48,51,52)(H2,60,61,62)/t36-,40-,41-,42+,46-/m1/s1
InChIKey FHLYYFPJDVYWQH-CPIGOPAHSA-N
SMILES CCCCCCCCCCCCCCCCCCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(O)(=O)OP(O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1OP(O)(O)=O)n1cnc2c(N)ncnc12
Metabolite of Species Details
Saccharomyces cerevisiae (NCBI:txid4932) Source: yeast.sf.net See: PubMed
Roles Classification
Chemical Role(s): acyl donor
Any donor that can transfer acyl groups between molecular entities.
(via acyl-CoA )
Biological Role(s): Saccharomyces cerevisiae metabolite
Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing hexacosanoyl-CoA (CHEBI:52966) has functional parent hexacosanoic acid (CHEBI:31009)
hexacosanoyl-CoA (CHEBI:52966) has role Saccharomyces cerevisiae metabolite (CHEBI:75772)
hexacosanoyl-CoA (CHEBI:52966) is a saturated fatty acyl-CoA (CHEBI:231546)
hexacosanoyl-CoA (CHEBI:52966) is a very long-chain fatty acyl-CoA (CHEBI:61910)
hexacosanoyl-CoA (CHEBI:52966) is conjugate acid of hexacosanoyl-CoA(4−) (CHEBI:64868)
Incoming 3-oxohexacosanoyl-CoA (CHEBI:52977) has functional parent hexacosanoyl-CoA (CHEBI:52966)
hexacosanoyl-CoA(4−) (CHEBI:64868) is conjugate base of hexacosanoyl-CoA (CHEBI:52966)
IUPAC Name
3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-({2-[(hexacosanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}butyl] dihydrogen diphosphate}
Synonyms Sources
C26:0-CoA ChEBI
C26:0-coenzyme A ChEBI
cerotoyl-CoA ChEBI
cerotoyl-coenzyme A ChEBI
hexacosanoyl-CoA (N-C26:0CoA) ChEBI
hexacosanoyl-coenzyme A ChEBI
Manual Xrefs Databases
CPD1G-277 MetaCyc
HMDB0006459 HMDB
View more database links
Registry Number Type Source
20717346 Reaxys Registry Number Reaxys
Citations
Haynes CA, Allegood JC, Sims K, Wang EW, Sullards MC, Merrill AH (2008)
Quantitation of fatty acyl-coenzyme As in mammalian cells by liquid chromatography-electrospray ionization tandem mass spectrometry.
Journal of lipid research 49, 1113-1125 [PubMed:18287618]
[show Abstract]
Sirakova TD, Dubey VS, Deb C, Daniel J, Korotkova TA, Abomoelak B, Kolattukudy PE (2006)
Identification of a diacylglycerol acyltransferase gene involved in accumulation of triacylglycerol in Mycobacterium tuberculosis under stress.
Microbiology (Reading, England) 152, 2717-2725 [PubMed:16946266]
[show Abstract]
Lageweg W, Wanders RJ (1993)
Studies on the effect of fenoprofen on the activation and oxidation of long chain and very long chain fatty acids in hepatocytes and subcellular fractions from rat liver.
Biochemical pharmacology 46, 79-85 [PubMed:8347139]
[show Abstract]
Lageweg W, Tager JM, Wanders RJ (1991)
Topography of very-long-chain-fatty-acid-activating activity in peroxisomes from rat liver.
The Biochemical journal 276 ( Pt 1), 53-56 [PubMed:1828148]
[show Abstract]
Last Modified
07 June 2024