![(1S,3R,4S)-3-[2-CYANOETHOXY-(DIISOPROPYLAMINO)-PHOSPHINOXYMETHYL]-5-N-(4-MONOMETHOXYTRITYL)-1-(URACIL-1-YL)-5-AZA-2-OXABICYCLO-[2.2.1]-HEPTANE](/api/spectrum/4bnBFZSV9LX/structure.png?h=300&w=458 "(1S,3R,4S)-3-[2-CYANOETHOXY-(DIISOPROPYLAMINO)-PHOSPHINOXYMETHYL]-5-N-(4-MONOMETHOXYTRITYL)-1-(URACIL-1-YL)-5-AZA-2-OXABICYCLO-[2.2.1]-HEPTANE")
| SpectraBase Compound ID | Fg3dbEMGVMl |
|---|---|
| InChI | InChI=1S/2C39H46N5O7P/c2*1-28(2)44(29(3)4)52(47,49-24-12-22-40)50-26-35-34-25-38(51-35,42-23-21-36(45)41-37(42)46)27-43(34)39(30-13-8-6-9-14-30,31-15-10-7-11-16-31)32-17-19-33(48-5)20-18-32/h2*6-11,13-21,23,28-29,34-35H,12,24-27H2,1-5H3,(H,41,45,46)/t2*34-,35+,38-,52?/m00/s1 |
| InChIKey | BKPJVYRTEHBVGD-WJWUPLBFSA-N |
| Mol Weight | 1455.6 g/mol |
| Molecular Formula | C78H92N10O14P2 |
| Exact Mass | 1454.626972 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4bnBFZSV9LX |
|---|---|
| Name | (1S,3R,4S)-3-[2-CYANOETHOXY-(DIISOPROPYLAMINO)-PHOSPHINOXYMETHYL]-5-N-(4-MONOMETHOXYTRITYL)-1-(URACIL-1-YL)-5-AZA-2-OXABICYCLO-[2.2.1]-HEPTANE |
| Compound Number | 18 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C78H92N10O14P2 |
| InChI | InChI=1S/2C39H46N5O7P/c2*1-28(2)44(29(3)4)52(47,49-24-12-22-40)50-26-35-34-25-38(51-35,42-23-21-36(45)41-37(42)46)27-43(34)39(30-13-8-6-9-14-30,31-15-10-7-11-16-31)32-17-19-33(48-5)20-18-32/h2*6-11,13-21,23,28-29,34-35H,12,24-27H2,1-5H3,(H,41,45,46)/t2*34-,35+,38-,52?/m00/s1 |
| InChIKey | BKPJVYRTEHBVGD-WJWUPLBFSA-N |
| Literature Reference Author | L.KVAERNO,R.H.WIGHTMAN,J.WENGEL |
| Literature Reference Citation | J.ORG.CHEM.,66,5106(2001) |
| Literature Reference DOI | 10.1021/jo015602v |
| Solvent | CDCl3 |
| Source File Reference | UWLU27184 |