![5'-O-(4,4'-DIMETHOXYTRITYL)-N(6)-BENZOYL-2'-O-[2-[(N,N-DIMETHYLAMINO)-OXY]-ETHYL]-ADENOSINE-3'-O-SUCCINATE](/api/spectrum/1ESH8tY4E5u/structure.png?h=300&w=458 "5'-O-(4,4'-DIMETHOXYTRITYL)-N(6)-BENZOYL-2'-O-[2-[(N,N-DIMETHYLAMINO)-OXY]-ETHYL]-ADENOSINE-3'-O-SUCCINATE")
| SpectraBase Compound ID | 4L2qosK8yXa |
|---|---|
| InChI | InChI=1S/C46H48N6O11/c1-51(2)61-26-25-59-41-40(63-38(55)24-23-37(53)54)36(62-45(41)52-29-49-39-42(47-28-48-43(39)52)50-44(56)30-11-7-5-8-12-30)27-60-46(31-13-9-6-10-14-31,32-15-19-34(57-3)20-16-32)33-17-21-35(58-4)22-18-33/h5-22,28-29,36,40-41,45H,23-27H2,1-4H3,(H,53,54)(H,47,48,50,56)/t36-,40-,41-,45-/m0/s1 |
| InChIKey | PECSJPAGGXSGBN-ZYPCQYQTSA-N |
| Mol Weight | 860.9 g/mol |
| Molecular Formula | C46H48N6O11 |
| Exact Mass | 860.338106 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1ESH8tY4E5u |
|---|---|
| Name | 5'-O-(4,4'-DIMETHOXYTRITYL)-N(6)-BENZOYL-2'-O-[2-[(N,N-DIMETHYLAMINO)-OXY]-ETHYL]-ADENOSINE-3'-O-SUCCINATE |
| Compound Number | 40 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C46H48N6O11 |
| InChI | InChI=1S/C46H48N6O11/c1-51(2)61-26-25-59-41-40(63-38(55)24-23-37(53)54)36(62-45(41)52-29-49-39-42(47-28-48-43(39)52)50-44(56)30-11-7-5-8-12-30)27-60-46(31-13-9-6-10-14-31,32-15-19-34(57-3)20-16-32)33-17-21-35(58-4)22-18-33/h5-22,28-29,36,40-41,45H,23-27H2,1-4H3,(H,53,54)(H,47,48,50,56)/t36-,40-,41-,45-/m0/s1 |
| InChIKey | PECSJPAGGXSGBN-ZYPCQYQTSA-N |
| Literature Reference Author | T.P.PRAKASH,A.M.KAWASAKI,A.S.FRASER,G.VASQUEZ,M.MANOHARAN |
| Literature Reference Citation | J.ORG.CHEM.,67,357(2002) |
| Literature Reference DOI | 10.1021/jo0103975 |
| Molecular Weight | 860.921 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMS24134 |