SpectraBase Compound ID | BRIqlwIzH5i |
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InChI | InChI=1S/C46H54N5O14PS/c1-27(2)41(54)47-35-21-23-50(44(55)48-35)42-39(59-5)37(53)33(63-42)26-62-66(7,67)65-38-34(64-43(40(38)60-6)51-24-22-36(52)49-45(51)56)25-61-46(28-11-9-8-10-12-28,29-13-17-31(57-3)18-14-29)30-15-19-32(58-4)20-16-30/h8-24,27,33-34,37-40,42-43,53H,25-26H2,1-7H3,(H,49,52,56)(H,47,48,54,55)/t33-,34-,37-,38-,39-,40-,42-,43-,66?/m0/s1 |
InChIKey | MUHPWRJSYYPINO-FOIXSOFFSA-N |
Mol Weight | 964.0 g/mol |
Molecular Formula | C46H54N5O14PS |
Exact Mass | 963.31256 g/mol |
SpectraBase Spectrum ID | 3We2nBjuhkF |
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Name | (RP)-5'-O-DMT-2'-OME-URIDIN-3'-YL-(3',5')-3'-O-(N4-ISOBUTYRYL-2'-OME-CYTIDINE)-3'-METHYLPHOSPHONOTHIOATE |
Compound Number | 3 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C46H54N5O14PS |
InChI | InChI=1S/C46H54N5O14PS/c1-27(2)41(54)47-35-21-23-50(44(55)48-35)42-39(59-5)37(53)33(63-42)26-62-66(7,67)65-38-34(64-43(40(38)60-6)51-24-22-36(52)49-45(51)56)25-61-46(28-11-9-8-10-12-28,29-13-17-31(57-3)18-14-29)30-15-19-32(58-4)20-16-30/h8-24,27,33-34,37-40,42-43,53H,25-26H2,1-7H3,(H,49,52,56)(H,47,48,54,55)/t33-,34-,37-,38-,39-,40-,42-,43-,66?/m0/s1 |
InChIKey | MUHPWRJSYYPINO-FOIXSOFFSA-N |
Literature Reference Author | L.A.WOZNIAK,M.JANICKA,M.BUKOWIECKA-MATUSIAK |
Literature Reference Citation | EUR.J.ORG.CHEM.,5189(2005) |
Solvent | CDCl3 |
Source File Reference | UWLU42661 |