![4-AMINO-7-(2',3'-O-ISOPROPYLIDENE-5'-O-MESYL-BETA-D-RIBOFURANOSYL)-5-[1''-(3''-TRIFLUOROACETAMIDO)-PROPYL]-7H-PYRROLO-[2,3-D]-PYRIMIDINE](/api/spectrum/FOffHSldtYW/structure.png?h=300&w=458 "4-AMINO-7-(2',3'-O-ISOPROPYLIDENE-5'-O-MESYL-BETA-D-RIBOFURANOSYL)-5-[1''-(3''-TRIFLUOROACETAMIDO)-PROPYL]-7H-PYRROLO-[2,3-D]-PYRIMIDINE")
| SpectraBase Compound ID | 8rHNnkAUhAS |
|---|---|
| InChI | InChI=1S/C20H26F3N5O7S/c1-19(2)34-13-11(8-32-36(3,30)31)33-17(14(13)35-19)28-7-10(12-15(24)26-9-27-16(12)28)5-4-6-25-18(29)20(21,22)23/h7,9,11,13-14,17H,4-6,8H2,1-3H3,(H,25,29)(H2,24,26,27)/t11-,13-,14-,17-/m1/s1 |
| InChIKey | XYUSLRCPYKORQO-LSCFUAHRSA-N |
| Mol Weight | 537.51 g/mol |
| Molecular Formula | C20H26F3N5O7S |
| Exact Mass | 537.150504 g/mol |
19F Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FOffHSldtYW |
|---|---|
| Name | 4-AMINO-7-(2',3'-O-ISOPROPYLIDENE-5'-O-MESYL-BETA-D-RIBOFURANOSYL)-5-[1''-(3''-TRIFLUOROACETAMIDO)-PROPYL]-7H-PYRROLO-[2,3-D]-PYRIMIDINE |
| Compound Number | 14 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C20H26F3N5O7S |
| InChI | InChI=1S/C20H26F3N5O7S/c1-19(2)34-13-11(8-32-36(3,30)31)33-17(14(13)35-19)28-7-10(12-15(24)26-9-27-16(12)28)5-4-6-25-18(29)20(21,22)23/h7,9,11,13-14,17H,4-6,8H2,1-3H3,(H,25,29)(H2,24,26,27)/t11-,13-,14-,17-/m1/s1 |
| InChIKey | XYUSLRCPYKORQO-LSCFUAHRSA-N |
| Literature Reference Author | F.KUNKEL,R.LURZ,E.WEINHOLD |
| Literature Reference Citation | MOLECULES,20,20805(2015) |
| Literature Reference DOI | 10.3390/molecules201119723 |
| Solvent | DMSO-D6 |
| Source File Reference | UWPA6111 |