![N(2)-ISOBUTYRYL-5'-O-(4,4'-DIMETHOXYTRITYL)-3'-O-(N,N-DIISOPROPYLAMINO)-[3-(N-TERT.-BUTYLCARBOXAMIDO)-1-PROPYLOXY]-PHOSPHINYL-2'-DEOXYGUANOSINE](/api/spectrum/I1I4MB5e6c5/structure.png?h=300&w=458 "N(2)-ISOBUTYRYL-5'-O-(4,4'-DIMETHOXYTRITYL)-3'-O-(N,N-DIISOPROPYLAMINO)-[3-(N-TERT.-BUTYLCARBOXAMIDO)-1-PROPYLOXY]-PHOSPHINYL-2'-DEOXYGUANOSINE")
| SpectraBase Compound ID | JYIVfV8xUzC |
|---|---|
| InChI | InChI=1S/C50H69N6O8P/c1-33(2)30-51-44-28-41-47(48(58)53-44)52-32-55(41)46-29-42(64-65(56(34(3)4)35(5)6)62-27-15-18-45(57)54-49(7,8)9)43(63-46)31-61-50(36-16-13-12-14-17-36,37-19-23-39(59-10)24-20-37)38-21-25-40(60-11)26-22-38/h12-14,16-17,19-26,28,32-35,42-43,46H,15,18,27,29-31H2,1-11H3,(H,54,57)(H2,51,53,58)/t42-,43+,46+,65?/m1/s1 |
| InChIKey | BQUVUDHHAFOVBM-ZRKLFKMJSA-N |
| Mol Weight | 913.1 g/mol |
| Molecular Formula | C50H69N6O8P |
| Exact Mass | 912.49145 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | I1I4MB5e6c5 |
|---|---|
| Name | N(2)-ISOBUTYRYL-5'-O-(4,4'-DIMETHOXYTRITYL)-3'-O-(N,N-DIISOPROPYLAMINO)-[3-(N-TERT.-BUTYLCARBOXAMIDO)-1-PROPYLOXY]-PHOSPHINYL-2'-DEOXYGUANOSINE |
| Compound Number | 1D |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C50H69N6O8P |
| InChI | InChI=1S/C50H69N6O8P/c1-33(2)30-51-44-28-41-47(48(58)53-44)52-32-55(41)46-29-42(64-65(56(34(3)4)35(5)6)62-27-15-18-45(57)54-49(7,8)9)43(63-46)31-61-50(36-16-13-12-14-17-36,37-19-23-39(59-10)24-20-37)38-21-25-40(60-11)26-22-38/h12-14,16-17,19-26,28,32-35,42-43,46H,15,18,27,29-31H2,1-11H3,(H,54,57)(H2,51,53,58)/t42-,43+,46+,65?/m1/s1 |
| InChIKey | BQUVUDHHAFOVBM-ZRKLFKMJSA-N |
| Literature Reference Author | A.WILK,M.K.CHMIELEWSKI,A.GRAJKOWSKI,L.R.PHILLIPS,S.L.BEAUCAG E |
| Literature Reference Citation | J.ORG.CHEM.,67,6430(2002) |
| Literature Reference DOI | 10.1021/jo0258608 |
| Solvent | C6D6 |
| Source File Reference | UWSI22020 |