CymitQuimica logo

CAS 102029-52-7

:

ACETOACETYL COENZYME A SODIUM SALT

Description:
Acetoacetyl coenzyme A sodium salt, with the CAS number 102029-52-7, is a biochemical compound that plays a crucial role in metabolic pathways, particularly in the synthesis and degradation of fatty acids and ketone bodies. This compound is a derivative of coenzyme A, which is essential for the transfer of acyl groups in various biochemical reactions. As a sodium salt, it is typically more soluble in aqueous solutions, facilitating its use in biological systems. The structure of acetoacetyl coenzyme A includes an acetoacetyl group linked to coenzyme A, allowing it to participate in enzymatic reactions as an acyl donor. Its characteristics include being a polar molecule, which enhances its reactivity and interaction with enzymes. This compound is significant in studies related to energy metabolism and can be utilized in research involving metabolic disorders or in the synthesis of other biochemical compounds. Overall, acetoacetyl coenzyme A sodium salt is an important intermediate in various biochemical pathways, reflecting its relevance in both physiological and pathological contexts.
Formula:C25H37N7Na3O18P3S
InChI:InChI=1/C25H40N7O18P3S.3Na/c1-13(33)8-16(35)54-7-6-27-15(34)4-5-28-23(38)20(37)25(2,3)10-47-53(44,45)50-52(42,43)46-9-14-19(49-51(39,40)41)18(36)24(48-14)32-12-31-17-21(26)29-11-30-22(17)32;;;/h11-12,14,18-20,24,36-37H,4-10H2,1-3H3,(H,27,34)(H,28,38)(H,42,43)(H,44,45)(H2,26,29,30)(H2,39,40,41);;;/q;3*+1/p-3/t14-,18-,19-,20?,24-;;;/m1.../s1
InChI key:KJJYKBIEKQJXHM-UHFFFAOYSA-K
SMILES:CC(=O)CC(=O)SCCN=C(CCN=C(C(C(C)(C)COP(=O)(O)OP(=O)(O)OCC1C(C(C(n2cnc3c(N)ncnc23)O1)O)OP(=O)(O)O)O)O)O.[Na].[Na].[Na]
Synonyms:
  • Acetoacetyl Coenzyme A Trisodium Salt &
  • Acetoacetyl Coenzyme A Sodium
  • Acetoacetyl coenzyme A
  • coenzyme A acetoacetyl derivative trisodium salt hydrate
  • Acetoacetyl coenzyme A hydrate sodium salt
  • adenosine, 5'-O-[[[[4-[[3-[[2-[(1,3-dioxobutyl)thio]ethyl]amino]-3-oxopropyl]amino]-3-hydroxy-2,2-dimethyl-4-oxobutoxy]hydroxyphosphinyl]oxy]hydroxyphosphinyl]-, 3'-(dihydrogen phosphate), trisodium salt
Found 8 products.