hexacosanoyl-CoA
Grundinformationen
- CAS
99313-57-2- Standard-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](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O- InChIKey
FHLYYFPJDVYWQH-CPIGOPAHSA-N- Summenformel
- C47H86N7O17P3S
- Durchschnittliche Molmasse
- 1.146,2 g/mol
- Monoisotopische Masse
- 1.145,50137647
Überblick
Hexacosanoyl-CoA is 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.. It has a role as a Saccharomyces cerevisiae metabolite. It is a saturated fatty acyl-CoA and a very long-chain fatty acyl-CoA. It is functionally related to a hexacosanoic acid. It is a conjugate acid of a hexacosanoyl-CoA(4-).
Namen und Bezeichner
- Bevorzugter Name
- hexacosanoyl-CoA
- IUPAC
- S-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] hexacosanethioate
Namen und Synonyme
hexacosanoyl-CoAcerotoyl-coacerotoyl-coenzyme AC26:0-coenzyme Ahexacosanoyl-coenzyme AC26:0-CoAhexacosanoyl-CoA (N-C26:0CoA)CHEBI:52966DTXSID8013437943'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-({2-[(hexacosanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}butyl] dihydrogen diphosphate}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)S-(2-(3-(((2R)-4-((((2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl)methoxy-hydroxyphosphoryl)oxy-hydroxyphosphoryl)oxy-2-hydroxy-3,3-dimethylbutanoyl)amino)propanoylamino)ethyl) hexacosanethioate
Weitere Namen anzeigen
S-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] hexacosanethioateRefChem:1086504DTXCID201772547C26:0 Coenzyme A99313-57-2C26:0 CoAorb3144318CoA 26:0
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 7,1
- Polarare Oberfläche (TPSA)
- 389 Ų
- H-Brücken-Donoren
- 9
- H-Brücken-Akzeptoren
- 22
- Frei drehbare Bindungen
- 44
- Schwere Atome
- 75
- Formalladung
- 0
- Komplexität
- 1.800
Experimentelle und physikochemische Eigenschaften
LipidsFatty Acyls [FA] -> Fatty esters [FA07] -> Fatty acyl CoAs [FA0705]
Physical DescriptionSolid
Chemie und Industrie
Pharmakologische Informationen
Cellular LocationsCytoplasm
Metabolite PathwaysAcylcarnitine Hexacosanoylcarnitine
Zugehörige Reaktionen
0
Keine Reaktionsaufzeichnungen unter den aktuellen Filterkriterien.
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