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CAS 102680-35-3

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Coenzyme A, S-(2E)-2-butenoate, tetralithium salt

Description:
Coenzyme A, S-(2E)-2-butenoate, tetralithium salt is a chemical compound that serves as a derivative of coenzyme A, which is crucial in various biochemical processes, particularly in the metabolism of fatty acids and the synthesis of acetyl-CoA. This compound features a butenoate moiety, indicating the presence of a double bond in the butanoic acid chain, which may influence its reactivity and interaction with biological systems. The tetralithium salt form suggests that the compound is ionically bonded to lithium ions, which can enhance its solubility in polar solvents and may affect its biological availability. The presence of lithium ions can also impart unique electrochemical properties, making it of interest in various applications, including potential therapeutic uses. Overall, this compound exemplifies the complexity of biochemical molecules and their derivatives, highlighting the interplay between structure and function in biological systems.
Formula:C25H40N7O17P3S·4Li
InChI:InChI=1S/C25H40N7O17P3S.4Li/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;;;;/h4-5,12-14,18-20,24,35-36H,6-11H2,1-3H3,(H,27,33)(H,28,37)(H,41,42)(H,43,44)(H2,26,29,30)(H2,38,39,40);;;;/b5-4+;;;;/t14-,18-,19-,20+,24-;;;;/m1..../s1
InChI key:InChIKey=BOUZFMPFSMEPQH-UBSBBMKYSA-N
SMILES:O[C@H]1[C@H](N2C=3C(N=C2)=C(N)N=CN3)O[C@H](COP(OP(OCC([C@H](C(NCCC(NCCSC(/C=C/C)=O)=O)=O)O)(C)C)(=O)O)(=O)O)[C@H]1OP(=O)(O)O.[Li]
Synonyms:
  • Coenzyme A, S-(2E)-2-butenoate, tetralithium salt
  • Coenzyme A, S-2-butenoate, tetralithium salt, (E)-
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