04:0 Coenzyme A (sodium salt)

Name: 04:0 Coenzyme A (sodium salt)
Brand: BOC Sciences
Rating: 5 (1 reviews)

CAS No.: 799812-79-6

Cat No.: BPG-3075

Purity: >99%

4.5

04:0 Coenzyme A is a coenzyme A derivative of butanoic acid. 04:0 Coenzyme A serves as an intermediate in the synthesis of butyrate, which is involved in maintaining colonic homeostasis and gut health. It also has an ability to inhibit citrate synthase (CS).

Category	Acyl CoA - Saturated Fatty Acid
Molecular Formula	C25H39N7Na3O17P3S
Molecular Weight	903.57
Appearance	Powder
Storage	Store at -20°C

Structure of 799812-79-6

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Specification

Synonyms	butanoyl Coenzyme A (sodium salt); butyryl Coenzyme A (sodium salt)
IUPACName	trisodium;[(2R,3R,5R)-5-(6-aminopurin-9-yl)-2-[[[[(3R)-4-[[3-(2-butanoylsulfanylethylamino)-3-oxopropyl]amino]-3-hydroxy-2,2-dimethyl-4-oxobutoxy]-oxidophosphoryl]oxy-oxidophosphoryl]oxymethyl]-4-hydroxyoxolan-3-yl] hydrogen phosphate
CanonicalSMILES	CCCC(=O)SCCNC(=O)CCNC(=O)C(C(C)(C)COP(=O)([O-])OP(=O)([O-])OCC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)[O-])O.[Na+].[Na+].[Na+]
InChI	InChI=1S/C25H42N7O17P3S.3Na/c1-4-5-16(34)53-9-8-27-15(33)6-7-28-23(37)20(36)25(2,3)11-46-52(43,44)49-51(41,42)45-10-14-19(48-50(38,39)40)18(35)24(47-14)32-13-31-17-21(26)29-12-30-22(17)32;;;/h12-14,18-20,24,35-36H,4-11H2,1-3H3,(H,27,33)(H,28,37)(H,41,42)(H,43,44)(H2,26,29,30)(H2,38,39,40);;;/q;3*+1/p-3/t14-,18?,19+,20+,24-;;;/m1.../s1
InChIKey	PRMIKLPNYYDDCC-XRHOYZRHSA-K
Purity	>99%
ShelfLife	1 Year
ExactMass	903.103
Hygroscopic	No
LightSensitive	No
PercentComposition	C 33.23%, H 4.35%, N 10.85%, Na 7.63%, O 30.10%, P 10.28%, S 3.55%