![5'-O-(4,4'-DIMETHOXYTRITYL)-3'-O-(N,N-DIISOPROPYLAMINO)-[2-[[THIOXO-(PHENYL)-METHYL]-AMINO]-PROPOXY]-PHOSPHINYL-2'-DEOXYTHYMIDINE;FAST-DIASTEREOME](/api/spectrum/CBDxEbMiQ2w/structure.png?h=300&w=458 "5'-O-(4,4'-DIMETHOXYTRITYL)-3'-O-(N,N-DIISOPROPYLAMINO)-[2-[[THIOXO-(PHENYL)-METHYL]-AMINO]-PROPOXY]-PHOSPHINYL-2'-DEOXYTHYMIDINE;FAST-DIASTEREOME")
| SpectraBase Compound ID | KRSgvoLZ5bn |
|---|---|
| InChI | InChI=1S/C47H57N4O8PS/c1-32(2)51(33(3)4)60(57-28-14-27-48-45(61)35-15-10-8-11-16-35)59-41-29-43(50-30-34(5)44(52)49-46(50)53)58-42(41)31-56-47(36-17-12-9-13-18-36,37-19-23-39(54-6)24-20-37)38-21-25-40(55-7)26-22-38/h8-13,15-26,30,32-33,41-43H,14,27-29,31H2,1-7H3,(H,48,61)(H,49,52,53)/t41-,42+,43+,60?/m1/s1 |
| InChIKey | KAGVOSFPKBZELJ-PCRSQVTMSA-N |
| Mol Weight | 869.0 g/mol |
| Molecular Formula | C47H57N4O8PS |
| Exact Mass | 868.363473 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CBDxEbMiQ2w |
|---|---|
| Name | 5'-O-(4,4'-DIMETHOXYTRITYL)-3'-O-(N,N-DIISOPROPYLAMINO)-[2-[[THIOXO-(PHENYL)-METHYL]-AMINO]-PROPOXY]-PHOSPHINYL-2'-DEOXYTHYMIDINE;SLOW-DIASTEREOME |
| Compound Number | 31 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C47H57N4O8PS |
| InChI | InChI=1S/C47H57N4O8PS/c1-32(2)51(33(3)4)60(57-28-14-27-48-45(61)35-15-10-8-11-16-35)59-41-29-43(50-30-34(5)44(52)49-46(50)53)58-42(41)31-56-47(36-17-12-9-13-18-36,37-19-23-39(54-6)24-20-37)38-21-25-40(55-7)26-22-38/h8-13,15-26,30,32-33,41-43H,14,27-29,31H2,1-7H3,(H,48,61)(H,49,52,53)/t41-,42+,43+,60?/m1/s1 |
| InChIKey | KAGVOSFPKBZELJ-PCRSQVTMSA-N |
| Literature Reference Author | A.P.GUZAEV,M.MANOHARAN |
| Literature Reference Citation | J.AM.CHEM.SOC.,123,783(2001) |
| Literature Reference DOI | 10.1021/ja0016396 |
| Solvent | CDCl3 |
| Source File Reference | UWSI23703 |