![5'-O-[5-[(TOL-4-YL)-SULFONYLOXY]-PENTYL]-ADENOSINE](/api/spectrum/BpbzUxBqdYN/structure.png?h=300&w=458 "5'-O-[5-[(TOL-4-YL)-SULFONYLOXY]-PENTYL]-ADENOSINE")
| SpectraBase Compound ID | EHc3w15huHx |
|---|---|
| InChI | InChI=1S/C22H29N5O7S/c1-14-5-7-15(8-6-14)35(30,31)33-10-4-2-3-9-32-11-16-18(28)19(29)22(34-16)27-13-26-17-20(23)24-12-25-21(17)27/h5-8,12-13,16,18-19,22,28-29H,2-4,9-11H2,1H3,(H2,23,24,25)/t16-,18-,19-,22-/m0/s1 |
| InChIKey | PDDYMNYZCNRCTA-FUOQNJDISA-N |
| Mol Weight | 507.56 g/mol |
| Molecular Formula | C22H29N5O7S |
| Exact Mass | 507.178769 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BpbzUxBqdYN |
|---|---|
| Name | 5'-O-[5-[(TOL-4-YL)-SULFONYLOXY]-PENTYL]-ADENOSINE |
| Compound Number | 12C |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H29N5O7S |
| InChI | InChI=1S/C22H29N5O7S/c1-14-5-7-15(8-6-14)35(30,31)33-10-4-2-3-9-32-11-16-18(28)19(29)22(34-16)27-13-26-17-20(23)24-12-25-21(17)27/h5-8,12-13,16,18-19,22,28-29H,2-4,9-11H2,1H3,(H2,23,24,25)/t16-,18-,19-,22-/m0/s1 |
| InChIKey | PDDYMNYZCNRCTA-FUOQNJDISA-N |
| Literature Reference Author | L.POPPE,W.E.HULL,J.RETEY |
| Literature Reference Citation | HELV.CHIM.ACTA,76,2367(1993) |
| Literature Reference DOI | 10.1002/hlca.19930760623 |
| Molecular Weight | 507.562 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWSK32 |