Coenzyme A, S-[4-(acetylamino)butanoate]
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![Coenzyme A, S-[4-(acetylamino)butanoate] structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/99e65ab1dfe8485e91f7aafa901e9880.png "Coenzyme A, S-[4-(acetylamino)butanoate]")
Coenzyme A, S-[4-(acetylamino)butanoate]
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CAS No:
74833-91-3
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Formula:
C27H45N8O18P3S
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Chemical Name:
Coenzyme A, S-[4-(acetylamino)butanoate]
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Synonyms:
Coenzyme A,S-[4-(acetylamino)butanoate];4-Acetamidobutyryl-CoA
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CAS No:
Description
4-acetamidobutanoyl-CoA is an acyl-CoA resulting from the formal condensation of the thiol group of coenzyme A with the carboxy group of 4-acetamidobutanoic acid. It derives from a butyryl-CoA. It is a conjugate acid of a 4-acetamidobutanoyl-CoA(4-).
Coenzyme A, S-[4-(acetylamino)butanoate] Use and Manufacturing
Fatty Acyls [FA] -> Fatty esters [FA07] -> Fatty acyl CoAs [FA0705]
Computed Properties
Molecular Weight:894.7
XLogP3:-6
Hydrogen Bond Donor Count:10
Hydrogen Bond Acceptor Count:23
Rotatable Bond Count:24
Exact Mass:894.17853878
Monoisotopic Mass:894.17853878
Topological Polar Surface Area:418
Heavy Atom Count:57
Complexity:1550
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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