02:0 Coenzyme A (sodium salt)

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Category	Acyl CoA - Saturated Fatty Acid
Catalog NO.	BPG-3073
Product Name	02:0 Coenzyme A (sodium salt)
CAS	799812-78-5
Molecular Formula	C23H35N7Na3O17P3S
Molecular Weight	875.52

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Description	Acetyl-CoA is an essential cofactor and carrier of acyl groups in enzymatic acetyl transfer reactions during protein post-translation. Oxidation of acetyl CoA in tricarboxylic acid cycle is associated with energy production.
Synonyms	acetoyl Coenzyme A (sodium salt)
IUPAC Name	trisodium;[(2R,3R,5R)-2-[[[[(3R)-4-[[3-(2-acetylsulfanylethylamino)-3-oxopropyl]amino]-3-hydroxy-2,2-dimethyl-4-oxobutoxy]-oxidophosphoryl]oxy-oxidophosphoryl]oxymethyl]-5-(6-aminopurin-9-yl)-4-hydroxyoxolan-3-yl] hydrogen phosphate
Canonical SMILES	CC(=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/C23H38N7O17P3S.3Na/c1-12(31)51-7-6-25-14(32)4-5-26-21(35)18(34)23(2,3)9-44-50(41,42)47-49(39,40)43-8-13-17(46-48(36,37)38)16(33)22(45-13)30-11-29-15-19(24)27-10-28-20(15)30;;;/h10-11,13,16-18,22,33-34H,4-9H2,1-3H3,(H,25,32)(H,26,35)(H,39,40)(H,41,42)(H2,24,27,28)(H2,36,37,38);;;/q;3*+1/p-3/t13-,16?,17+,18+,22-;;;/m1.../s1
InChIKey	CRTIJMBXIFKWCA-LCNGPWNRSA-K
Purity	>99%
Appearance	Powder
Shelf Life	1 Year
Storage	Store at -20°C
Exact Mass	875.172
Hygroscopic	No
Light Sensitive	No
Percent Composition	C 31.55%, H 4.03%, N 11.20%, Na 7.88%, O 31.07%, P 10.61%, S 3.66%

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