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CAS 100940-62-3

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Mercurate(5-), [carbonato(2-)-κO][(cytidine-κC5) 5′-(triphosphato)(5-)]-, pentahydrogen, compd. with N,N-diethylethanamine (1:4)

Description:
Mercurate(5-), specifically the compound described as [carbonato(2-)-κO][(cytidine-κC5) 5′-(triphosphato)(5-)]-, pentahydrogen, complexed with N,N-diethylethanamine in a 1:4 ratio, is a complex chemical species that features a mercuric ion coordinated with a cytidine triphosphate derivative and a carbonate group. The presence of the mercurate ion suggests potential applications in biochemistry, particularly in studies involving nucleotides and their interactions. The cytidine component indicates that this compound may play a role in nucleotide metabolism or signaling pathways. The pentahydrogen designation implies the presence of five protons, which may influence the compound's solubility and reactivity. The coordination with N,N-diethylethanamine suggests that this amine may stabilize the complex or enhance its solubility in organic solvents. Overall, this compound exemplifies the intricate interactions between metal ions and biological molecules, highlighting its potential relevance in biochemical research and applications.
Formula:C10H11HgN3O17P3·4C6H15N·5H
InChI:InChI=1S/C9H15N3O14P3.C6H15N.CH2O3.Hg/c10-5-1-2-12(9(15)11-5)8-7(14)6(13)4(24-8)3-23-28(19,20)26-29(21,22)25-27(16,17)18;1-4-7(5-2)6-3;2-1(3)4;/h2,4,6-8,13-14H,3H2,(H,19,20)(H,21,22)(H2,10,11,15)(H2,16,17,18);4-6H2,1-3H3;(H2,2,3,4);/q-1;;;+2/p-1
InChI key:InChIKey=BJWOSTZYOYRCLN-UHFFFAOYSA-M
SMILES:OC1C(OC(COP(OP(OP(=O)([O-])[O-])(=O)[O-])(=O)[O-])C1O)N2C=[C-]([Hg+2][O-]C([O-])=O)C(N)=NC2=O.[H+].N(CC)(CC)CC
Synonyms:
  • Ethanamine, N,N-diethyl-, [carbonato(2-)-O][cytidine 5′-(triphosphato)(5-)-C5]mercurate(5-) (4:1)
  • Mercurate(5-), [carbonato(2-)-O][cytidine 5′-(triphosphato)(5-)-C5]-, pentahydrogen, compd. with N,N-diethylethanamine (1:4)
  • Cytidine 5′-(tetrahydrogen triphosphate), mercury complex
  • Carbonic acid, mercury complex
  • Mercurate(5-), [carbonato(2-)-κO][(cytidine-κC5) 5′-(triphosphato)(5-)]-, pentahydrogen, compd. with N,N-diethylethanamine (1:4)
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