![8-AMINO-[1''-(N''-DANSYL)-4''-AMINOBUTYL]-5'-O-MESYLADENOSINE](/api/spectrum/DsPG5pfzs3V/structure.png?h=300&w=458 "8-AMINO-[1''-(N''-DANSYL)-4''-AMINOBUTYL]-5'-O-MESYLADENOSINE")
| SpectraBase Compound ID | 2rjt8BDMoE9 |
|---|---|
| InChI | InChI=1S/C27H36N8O8S2/c1-34(2)18-10-6-9-17-16(18)8-7-11-20(17)45(40,41)32-13-5-4-12-29-27-33-21-24(28)30-15-31-25(21)35(27)26-23(37)22(36)19(43-26)14-42-44(3,38)39/h6-11,15,19,22-23,26,32,36-37H,4-5,12-14H2,1-3H3,(H,29,33)(H2,28,30,31)/t19-,22-,23-,26-/m0/s1 |
| InChIKey | IBSRKTAFQNYYJW-SURPGJSWSA-N |
| Mol Weight | 664.8 g/mol |
| Molecular Formula | C27H36N8O8S2 |
| Exact Mass | 664.209752 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DsPG5pfzs3V |
|---|---|
| Name | 8-AMINO-[1''-(N''-DANSYL)-4''-AMINOBUTYL]-5'-O-MESYLADENOSINE |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H36N8O8S2 |
| InChI | InChI=1S/C27H36N8O8S2/c1-34(2)18-10-6-9-17-16(18)8-7-11-20(17)45(40,41)32-13-5-4-12-29-27-33-21-24(28)30-15-31-25(21)35(27)26-23(37)22(36)19(43-26)14-42-44(3,38)39/h6-11,15,19,22-23,26,32,36-37H,4-5,12-14H2,1-3H3,(H,29,33)(H2,28,30,31)/t19-,22-,23-,26-/m0/s1 |
| InChIKey | IBSRKTAFQNYYJW-SURPGJSWSA-N |
| Literature Reference Author | G.PLJEVALJCIC,M.PIGNOT,E.WEINHOLD |
| Literature Reference Citation | J.AM.CHEM.SOC.,125,3486(2003) |
| Literature Reference DOI | 10.1021/ja021106s |
| Molecular Weight | 664.752 g/mol |
| Sample ID | 40809 |
| Solvent | DMSO-D6 |