| SpectraBase Compound ID | J2KSnA451t5 |
|---|---|
| InChI | InChI=1S/C57H59N2O7PS/c1-56(2,44-66-67(62,64-42-47-28-14-5-15-29-47)65-43-48-30-16-6-17-31-48)53(63-41-46-26-12-4-13-27-46)55(61)59-52(40-45-24-10-3-11-25-45)54(60)58-38-39-68-57(49-32-18-7-19-33-49,50-34-20-8-21-35-50)51-36-22-9-23-37-51/h3-37,52-53H,38-44H2,1-2H3,(H,58,60)(H,59,61)/t52-,53+/m1/s1 |
| InChIKey | WEQVOSWHFXALKL-UVJRJONQSA-N |
| Mol Weight | 947.1 g/mol |
| Molecular Formula | C57H59N2O7PS |
| Exact Mass | 946.37806 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HzPJTe7kJT6 |
|---|---|
| Name | WEQVOSWHFXALKL-UVJRJONQSA-N |
| Compound Number | 23B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C57H59N2O7PS |
| InChI | InChI=1S/C57H59N2O7PS/c1-56(2,44-66-67(62,64-42-47-28-14-5-15-29-47)65-43-48-30-16-6-17-31-48)53(63-41-46-26-12-4-13-27-46)55(61)59-52(40-45-24-10-3-11-25-45)54(60)58-38-39-68-57(49-32-18-7-19-33-49,50-34-20-8-21-35-50)51-36-22-9-23-37-51/h3-37,52-53H,38-44H2,1-2H3,(H,58,60)(H,59,61)/t52-,53+/m1/s1 |
| InChIKey | WEQVOSWHFXALKL-UVJRJONQSA-N |
| Literature Reference Author | A.L.MANDEL,J.J.L.CLAIR,M.D.BURKART |
| Literature Reference Citation | ORG.LETTERS,6,4801(2004) |
| Literature Reference DOI | 10.1021/ol048853+ |
| Solvent | CDCl3 |
| Source File Reference | UWSI34513 |