![(3'S,5'R)-N4-BENZOYL-1-{2'-DEOXY-5'-O-[(4,4'-DIMETHOXYTRIPHENYL)-METHYL]-3',5'-ETHANO-3'-O-[4-(4-NITROPHENYLOXY)-SUCCINYL]-BETA-D-RIBOFURANOSYL}-CYTOSINE](/api/spectrum/9rhF5g43y5R/structure.png?h=300&w=458 "(3'S,5'R)-N4-BENZOYL-1-{2'-DEOXY-5'-O-[(4,4'-DIMETHOXYTRIPHENYL)-METHYL]-3',5'-ETHANO-3'-O-[4-(4-NITROPHENYLOXY)-SUCCINYL]-BETA-D-RIBOFURANOSYL}-CYTOSINE")
| SpectraBase Compound ID | 2p1kis71S7Q |
|---|---|
| InChI | InChI=1S/C49H44N4O12/c1-60-37-19-13-34(14-20-37)49(33-11-7-4-8-12-33,35-15-21-38(61-2)22-16-35)64-40-27-29-48(65-44(55)26-25-43(54)62-39-23-17-36(18-24-39)53(58)59)31-42(63-45(40)48)52-30-28-41(51-47(52)57)50-46(56)32-9-5-3-6-10-32/h3-24,28,30,40,42,45H,25-27,29,31H2,1-2H3,(H,50,51,56,57)/t40-,42-,45-,48+/m1/s1 |
| InChIKey | ZZGHDAVFOCTJJD-WRJHURNWSA-N |
| Mol Weight | 880.9 g/mol |
| Molecular Formula | C49H44N4O12 |
| Exact Mass | 880.295573 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9rhF5g43y5R |
|---|---|
| Name | (3'S,5'R)-N4-BENZOYL-1-{2'-DEOXY-5'-O-[(4,4'-DIMETHOXYTRIPHENYL)-METHYL]-3',5'-ETHANO-3'-O-[4-(4-NITROPHENYLOXY)-SUCCINYL]-BETA-D-RIBOFURANOSYL}-CYTOSINE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C49H44N4O12 |
| InChI | InChI=1S/C49H44N4O12/c1-60-37-19-13-34(14-20-37)49(33-11-7-4-8-12-33,35-15-21-38(61-2)22-16-35)64-40-27-29-48(65-44(55)26-25-43(54)62-39-23-17-36(18-24-39)53(58)59)31-42(63-45(40)48)52-30-28-41(51-47(52)57)50-46(56)32-9-5-3-6-10-32/h3-24,28,30,40,42,45H,25-27,29,31H2,1-2H3,(H,50,51,56,57)/t40-,42-,45-,48+/m1/s1 |
| InChIKey | ZZGHDAVFOCTJJD-WRJHURNWSA-N |
| Literature Reference Author | M.TARKOEY,M.BOLLI,C.LEUMANN |
| Literature Reference Citation | HELV.CHIM.ACTA,77,716(1994) |
| Molecular Weight | 880.908 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWPR1369 |