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Acetyl coenzyme A-[13C2] lithium salt

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General Information
Catalog: BLP-000009
Molecular Formula: C21[13C]2H38N7O17P3S.xLi+
Molecular Weight: 811.56 (free acid)

Chemical Structure

Description	Acetyl coenzyme A-[13C2] lithium salt, is the labelled analogue of Acetyl coenzyme A. Acetyl coenzyme A is the precursor to HMG CoA, an essential component in the synthesis of cholesterol and ketone.
Synonyms	Acetyl-1,2-13C2 coenzyme A lithium salt
IUPAC Name	lithium 2-((((((4-((3-((2-((acetyl-13C2)thio)ethyl)amino)-3-oxopropyl)amino)-3-hydroxy-2,2-dimethyl-4-oxobutoxy)oxidophosphoryl)oxy)(hydroxy)phosphoryl)oxy)methyl)-5-(6-amino-9H-purin-9-yl)-4-hydroxytetrahydrofuran-3-yl phosphate
Related CAS	72-89-9 (unlabelled free base)
InChI	InChI=1S/C23H38N7O17P3S.3Li/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/i1+1,12+1;;;
InChI Key	FTRFBNATWBKIQU-AMVXMALOSA-K
Purity	95% (CP); 99% atom 13C
Solubility	Soluble in Methanol, Water
Appearance	Off-white Solid