Hexanoyl coenzyme A trilithium salt hydrate

SIGMA/H2012 - ≥85%

Synonym: Caproyl Coenzyme A trilithium salt

CAS Number: 103476-19-3 (anhydrous)
Empirical Formula (Hill Notation): C₂₇H₄₃Li₃N₇O₁₇P₃S · xH₂O
Molecular Weight: 883.48 (anhydrous basis)
Linear Formula: C₂₇H₄₃Li₃N₇O₁₇P₃S · xH₂O
Product Type: Chemical

Catalog Number	PKG Qty.	Price	Quantity


45-H2012-5MG	5 mg	$278.00 1/EA		Add To Favorites
45-H2012-10MG	10 mg	$479.00 1/EA		Add To Favorites

Properties
Descriptions
Safety Info.
Basic Data

assay	≥85%
InChI	1S/C27H46N7O17P3S.3Li.H2O/c1-4-5-6-7-18(36)55-11-10-29-17(35)8-9-30-25(39)22(38)27(2,3)13-48-54(45,46)51-53(43,44)47-12-16-21(50-52(40,41)42)20(37)26(49-16)34-15-33-19-23(28)31-14-32-24(19)34;;;;/h14-16,20-22,26,37-38H,4-13H2,1-3H3,(H,29,35)(H,30,39)(H,43,44)(H,45,46)(H2,28,31,32)(H2,40,41,42);;;;1H2/q;3*+1;/p-3/t16-,20-,21-,22+,26-;;;;/m1..../s1
InChI key	YMMJFYLVSRICJX-ZTADYLHKSA-K
Quality Level	200
SMILES string	[Li+].[Li+].[Li+].O.CCCCCC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP([O-])(=O)OP([O-])(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1OP(O)([O-])=O)n2cnc3c(N)ncnc23
storage temp.	−20°C

Application:	Hexanoyl coenzyme A trilithium salt hydrate may be used as a standard for liquid chromatography-tandem mass spectrometry (LC-MS/MS).
Biochem/physiol Actions:	Coenzyme A functions as an acyl group carrier, acetyl-CoA. Hexanoyl CoA is involved in fatty acid oxidation, lipid biosynthesis, and ceramide formation. Ghrelin O-acyltransferase (GOAT) has a preference for n-hexanoyl-CoA over n-octanoyl-CoA as an acyl donor. Hexanoyl CoA is also used as a starter unit for polyketide biosynthesis.
Packaging:	5, 10 mg in glass bottle

RIDADR	NONH for all modes of transport
WGK Germany	WGK 3
Flash Point(F)	Not applicable
Flash Point(C)	Not applicable

Purity	≥85%
Storage Temp.	−20°C
UNSPSC	41106305

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