![1-[2-DEOXY-3,5-DI-O,O-(4-METHYLBENZOYL)-ALPHA-D-RIBOFURANOSYL]-2-(PHENYLAMINO)-4-PYRIMIDINONE](/api/spectrum/2ZpZO0RSkpS/structure.png?h=300&w=458 "1-[2-DEOXY-3,5-DI-O,O-(4-METHYLBENZOYL)-ALPHA-D-RIBOFURANOSYL]-2-(PHENYLAMINO)-4-PYRIMIDINONE")
| SpectraBase Compound ID | 4i0Ur5SB215 |
|---|---|
| InChI | InChI=1S/C31H29N3O6/c1-20-8-12-22(13-9-20)29(36)38-19-26-25(40-30(37)23-14-10-21(2)11-15-23)18-28(39-26)34-17-16-27(35)33-31(34)32-24-6-4-3-5-7-24/h3-17,25-26,28H,18-19H2,1-2H3,(H,32,33,35)/t25-,26+,28-/m1/s1 |
| InChIKey | LYZNOLDICUGCBP-FULLSBAXSA-N |
| Mol Weight | 539.59 g/mol |
| Molecular Formula | C31H29N3O6 |
| Exact Mass | 539.205636 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2ZpZO0RSkpS |
|---|---|
| Name | 1-[2-DEOXY-3,5-DI-O,O-(4-METHYLBENZOYL)-ALPHA-D-RIBOFURANOSYL]-2-(PHENYLAMINO)-4-PYRIMIDINONE |
| Compound Number | 8A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H29N3O6 |
| InChI | InChI=1S/C31H29N3O6/c1-20-8-12-22(13-9-20)29(36)38-19-26-25(40-30(37)23-14-10-21(2)11-15-23)18-28(39-26)34-17-16-27(35)33-31(34)32-24-6-4-3-5-7-24/h3-17,25-26,28H,18-19H2,1-2H3,(H,32,33,35)/t25-,26+,28-/m1/s1 |
| InChIKey | LYZNOLDICUGCBP-FULLSBAXSA-N |
| Literature Reference Author | O.M.ALI |
| Literature Reference Citation | MH.CHEM.,138,917(2007) |
| Literature Reference DOI | 10.1007/s00706-007-0671-9 |
| Molecular Weight | 539.588 g/mol |
| Sample ID | 68695 |
| Solvent | CDCl3 |