![3-[5'-O-[N-(BENZYLOXYCARBONYL)-VALYLPROLYLVALYL]-2'-DEOXY-BETA-D-RIBOFURANOSYL]-6-(PARA-PENTYLPHENYL)-2,3-DIHYDROFURO-[2.3-D]-PYRIMIDIN-2-ONE](/api/spectrum/3anlnjiBwuh/structure.png?h=300&w=458 "3-[5'-O-[N-(BENZYLOXYCARBONYL)-VALYLPROLYLVALYL]-2'-DEOXY-BETA-D-RIBOFURANOSYL]-6-(PARA-PENTYLPHENYL)-2,3-DIHYDROFURO-[2.3-D]-PYRIMIDIN-2-ONE")
| SpectraBase Compound ID | 6EoZIyVqOHp |
|---|---|
| InChI | InChI=1S/C45H57N5O10/c1-6-7-9-13-29-17-19-31(20-18-29)35-22-32-24-50(44(55)48-41(32)60-35)37-23-34(51)36(59-37)26-57-43(54)39(28(4)5)46-40(52)33-16-12-21-49(33)42(53)38(27(2)3)47-45(56)58-25-30-14-10-8-11-15-30/h8,10-11,14-15,17-20,22,24,27-28,33-34,36-39,51H,6-7,9,12-13,16,21,23,25-26H2,1-5H3,(H,46,52)(H,47,56) |
| InChIKey | XBVUYFHMXZAGHQ-UHFFFAOYSA-N |
| Mol Weight | 828.0 g/mol |
| Molecular Formula | C45H57N5O10 |
| Exact Mass | 827.410543 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 3anlnjiBwuh |
|---|---|
| Name | 3-[5'-O-[N-(BENZYLOXYCARBONYL)-VALYLPROLYLVALYL]-2'-DEOXY-BETA-D-RIBOFURANOSYL]-6-(PARA-PENTYLPHENYL)-2,3-DIHYDROFURO-[2.3-D]-PYRIMIDIN-2-ONE |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C45H57N5O10 |
| InChI | InChI=1S/C45H57N5O10/c1-6-7-9-13-29-17-19-31(20-18-29)35-22-32-24-50(44(55)48-41(32)60-35)37-23-34(51)36(59-37)26-57-43(54)39(28(4)5)46-40(52)33-16-12-21-49(33)42(53)38(27(2)3)47-45(56)58-25-30-14-10-8-11-15-30/h8,10-11,14-15,17-20,22,24,27-28,33-34,36-39,51H,6-7,9,12-13,16,21,23,25-26H2,1-5H3,(H,46,52)(H,47,56) |
| InChIKey | XBVUYFHMXZAGHQ-UHFFFAOYSA-N |
| Literature Reference Author | A.DIEZ-TORRUBIA,J.BALZARINI,G.ANDREI,R.SNOECK,I.DEMEESTER,M. J.CAMARASA,S.VELAZQU |
| Literature Reference Citation | J.MED.CHEM.,54,1927(2011) |
| Literature Reference DOI | 10.1021/jm101624e |
| Molecular Weight | 827.975 g/mol |
| Solvent | ACETONE-D6 |
| Source File Reference | UWMZ48188 |