![7-FORMYL-4-OXO-2-PIVALOYLAMINO-9-[(2,3,5-TRI-O-BENZOYL)-BETA-D-RIBOFURANOSYL]-9H-PYRROLO-[2,3-D]-PYRIMIDINE](/api/spectrum/EfXqq34zGJ2/structure.png?h=300&w=458 "7-FORMYL-4-OXO-2-PIVALOYLAMINO-9-[(2,3,5-TRI-O-BENZOYL)-BETA-D-RIBOFURANOSYL]-9H-PYRROLO-[2,3-D]-PYRIMIDINE")
| SpectraBase Compound ID | Ajob4CdJHh |
|---|---|
| InChI | InChI=1S/C38H34N4O10/c1-38(2,3)36(48)41-37-39-30-27(31(44)40-37)25(20-43)19-42(30)32-29(52-35(47)24-17-11-6-12-18-24)28(51-34(46)23-15-9-5-10-16-23)26(50-32)21-49-33(45)22-13-7-4-8-14-22/h4-20,26,28-29,32H,21H2,1-3H3,(H2,39,40,41,44,48)/t26-,28-,29-,32-/m0/s1 |
| InChIKey | ABNPJHTZDDINIB-KDWIKIOXSA-N |
| Mol Weight | 706.7 g/mol |
| Molecular Formula | C38H34N4O10 |
| Exact Mass | 706.227493 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EfXqq34zGJ2 |
|---|---|
| Name | 7-FORMYL-4-OXO-2-PIVALOYLAMINO-9-[(2,3,5-TRI-O-BENZOYL)-BETA-D-RIBOFURANOSYL]-9H-PYRROLO-[2,3-D]-PYRIMIDINE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C38H34N4O10 |
| InChI | InChI=1S/C38H34N4O10/c1-38(2,3)36(48)41-37-39-30-27(31(44)40-37)25(20-43)19-42(30)32-29(52-35(47)24-17-11-6-12-18-24)28(51-34(46)23-15-9-5-10-16-23)26(50-32)21-49-33(45)22-13-7-4-8-14-22/h4-20,26,28-29,32H,21H2,1-3H3,(H2,39,40,41,44,48)/t26-,28-,29-,32-/m0/s1 |
| InChIKey | ABNPJHTZDDINIB-KDWIKIOXSA-N |
| Literature Reference Author | I.THOMA,T.CARELL |
| Literature Reference Citation | EUR.J.ORG.CHEM.,2013,4483(2013) |
| Literature Reference DOI | 10.1002/ejoc.201300586 |
| Molecular Weight | 706.709 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWBT18820 |