| SpectraBase Compound ID | BCbx51pkPPd |
|---|---|
| InChI | InChI=1S/C34H37F2N6O10PS/c1-6-48-53(54,49-7-2)34(35,36)26-25(18-47-21(4)44)51-31(28(26)50-22(5)45)41-19-37-27-29(41)39-32(38-20(3)43)40-30(27)52-33(46)42(23-14-10-8-11-15-23)24-16-12-9-13-17-24/h8-17,19,25-26,28,31H,6-7,18H2,1-5H3,(H,38,39,40,43)/t25-,26-,28-,31-/m0/s1 |
| InChIKey | SGDWQCKMTFFJTL-XZTBDSORSA-N |
| Mol Weight | 790.7 g/mol |
| Molecular Formula | C34H37F2N6O10PS |
| Exact Mass | 790.199756 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9y4kKfDHD1r |
|---|---|
| Name | 2-N-ACETYL-9-N-(2,5-DI-O-ACETYL-3-DEOXY-3-(O,O-DIETHYLPHOSPHONOTHIO)-DIFLUOROMETHYL-BETA-D-RIBOFURANOSYL)-6-O-DIPHENYLCARBAMOYLGUANINE |
| Compound Number | 51 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H37F2N6O10PS |
| InChI | InChI=1S/C34H37F2N6O10PS/c1-6-48-53(54,49-7-2)34(35,36)26-25(18-47-21(4)44)51-31(28(26)50-22(5)45)41-19-37-27-29(41)39-32(38-20(3)43)40-30(27)52-33(46)42(23-14-10-8-11-15-23)24-16-12-9-13-17-24/h8-17,19,25-26,28,31H,6-7,18H2,1-5H3,(H,38,39,40,43)/t25-,26-,28-,31-/m0/s1 |
| InChIKey | SGDWQCKMTFFJTL-XZTBDSORSA-N |
| Literature Reference Author | C.LOPIN,A.GAUTIER,G.COUHIER,S.R.PIETTRE |
| Literature Reference Citation | J.AM.CHEM.SOC.,124,14668(2002) |
| Literature Reference DOI | 10.1021/ja027850u |
| Solvent | CDCl3 |
| Source File Reference | UWLU47094 |