| SpectraBase Compound ID | GNStOJpsjs6 |
|---|---|
| InChI | InChI=1S/C31H44N6O5/c1-2-3-4-5-6-7-8-9-10-11-15-18-24(39)35-25-23(19-38)42-31(27(25)40)37-21-34-26-28(32-20-33-29(26)37)36-30(41)22-16-13-12-14-17-22/h12-14,16-17,20-21,23,25,27,31,38,40H,2-11,15,18-19H2,1H3,(H,35,39)(H,32,33,36,41) |
| InChIKey | IXGRRTASWKIHMU-UHFFFAOYSA-N |
| Mol Weight | 580.7 g/mol |
| Molecular Formula | C31H44N6O5 |
| Exact Mass | 580.337319 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BncTfzoPwbe |
|---|---|
| Name | 3'-DEOXY-3'-(TETRADECANAMIDO)-N(6)-BENZOYL-ADENOSINE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H44N6O5 |
| InChI | InChI=1S/C31H44N6O5/c1-2-3-4-5-6-7-8-9-10-11-15-18-24(39)35-25-23(19-38)42-31(27(25)40)37-21-34-26-28(32-20-33-29(26)37)36-30(41)22-16-13-12-14-17-22/h12-14,16-17,20-21,23,25,27,31,38,40H,2-11,15,18-19H2,1H3,(H,35,39)(H,32,33,36,41) |
| InChIKey | IXGRRTASWKIHMU-UHFFFAOYSA-N |
| Literature Reference Author | G.M.VISSER,M.TROMP,J.VANWESTRENEN,O.SCHIPPERUS,J.H.VANBOOM |
| Literature Reference Citation | REC.TR.CH.P.-B.,105,85(1986) |
| Literature Reference DOI | 10.1002/recl.19861050303 |
| Molecular Weight | 580.728 g/mol |
| Solvent | CDCl3:CD3OD |
| Source File Reference | UWED1944 |