| SpectraBase Compound ID | 1prMyztGBsv |
|---|---|
| InChI | InChI=1S/C46H84N3O11P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-41(51)59-43-39(38-57-61(54,55)56-37-36-49(3,4)5)58-45(48-35-34-40(50)47-46(48)53)44(43)60-42(52)33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h34-35,39,43-45H,6-33,36-38H2,1-5H3,(H-,47,50,53,54,55)/t39-,43-,44-,45-/m0/s1 |
| InChIKey | CUFSSOJKLFNETR-HVWIWKRUSA-N |
| Mol Weight | 886.2 g/mol |
| Molecular Formula | C46H84N3O11P |
| Exact Mass | 885.584348 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3pT9u7PvLku |
|---|---|
| Name | 1,2-DIPALMITOYL-URIDINO-PHOSPHOCHOLINE |
| Compound Number | 5B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C46H84N3O11P |
| InChI | InChI=1S/C46H84N3O11P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-41(51)59-43-39(38-57-61(54,55)56-37-36-49(3,4)5)58-45(48-35-34-40(50)47-46(48)53)44(43)60-42(52)33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h34-35,39,43-45H,6-33,36-38H2,1-5H3,(H-,47,50,53,54,55)/t39-,43-,44-,45-/m0/s1 |
| InChIKey | CUFSSOJKLFNETR-HVWIWKRUSA-N |
| Literature Reference Author | L.MOREAU,P.BARTHELEMY,M.E.MAATAOUI,M.W.GRINSTAFF |
| Literature Reference Citation | J.AM.CHEM.SOC.,126,7533(2004) |
| Literature Reference DOI | 10.1021/ja039597j |
| Solvent | CDCl3 |
| Source File Reference | UWLU36542 |