![N(6)-BENZOYL-9-[3'-N-[BIS-(PHENYL)-(4-METHOXYPHENYL)-METHYL]-3'-DEOXY-ALPHA-L-THREO-FURANOSYL]-ADENINE](/api/spectrum/2T9m7JcqwY9/structure.png?h=300&w=458 "N(6)-BENZOYL-9-[3'-N-[BIS-(PHENYL)-(4-METHOXYPHENYL)-METHYL]-3'-DEOXY-ALPHA-L-THREO-FURANOSYL]-ADENINE")
| SpectraBase Compound ID | 6rbqax3t5Na |
|---|---|
| InChI | InChI=1S/C36H32N6O4/c1-45-28-19-17-27(18-20-28)36(25-13-7-3-8-14-25,26-15-9-4-10-16-26)41-29-21-46-35(31(29)43)42-23-39-30-32(37-22-38-33(30)42)40-34(44)24-11-5-2-6-12-24/h2-20,22-23,29,31,35,41,43H,21H2,1H3,(H,37,38,40,44)/t29-,31+,35+/m1/s1 |
| InChIKey | DDBPTINTPPJKSM-LHSWRAOPSA-N |
| Mol Weight | 612.7 g/mol |
| Molecular Formula | C36H32N6O4 |
| Exact Mass | 612.248504 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2T9m7JcqwY9 |
|---|---|
| Name | N(6)-BENZOYL-9-[3'-N-[BIS-(PHENYL)-(4-METHOXYPHENYL)-METHYL]-3'-DEOXY-ALPHA-L-THREO-FURANOSYL]-ADENINE |
| Compound Number | 1B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H32N6O4 |
| InChI | InChI=1S/C36H32N6O4/c1-45-28-19-17-27(18-20-28)36(25-13-7-3-8-14-25,26-15-9-4-10-16-26)41-29-21-46-35(31(29)43)42-23-39-30-32(37-22-38-33(30)42)40-34(44)24-11-5-2-6-12-24/h2-20,22-23,29,31,35,41,43H,21H2,1H3,(H,37,38,40,44)/t29-,31+,35+/m1/s1 |
| InChIKey | DDBPTINTPPJKSM-LHSWRAOPSA-N |
| Literature Reference Author | M.FERENCIC,G.REDDY,X.WU,S.GUNTHA,J.NANDY,R.KRISHNAMURTHY,A.E SCHENMOSER |
| Literature Reference Citation | CHEM.BIODIV.,1,939(2004) |
| Literature Reference DOI | 10.1002/cbdv.200490083 |
| Molecular Weight | 612.688 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMS21503 |