![2',3'-ISOPROPYLIDENE-N6-[((DIOCTADECYL)-AMINO)-SUCCINYL-AMINOHEXYL]-ADENOSINE-5'-MONOPHOSPHATE;DODA-HM-N6-AMP-AC](/api/spectrum/HY3NPdm2AIj/structure.png?h=300&w=458 "2',3'-ISOPROPYLIDENE-N6-[((DIOCTADECYL)-AMINO)-SUCCINYL-AMINOHEXYL]-ADENOSINE-5'-MONOPHOSPHATE;DODA-HM-N6-AMP-AC")
| SpectraBase Compound ID | 6jZQWEOoQkx |
|---|---|
| InChI | InChI=1S/C59H108N7O9P/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-35-39-45-65(46-40-36-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2)52(68)42-41-51(67)60-43-37-33-34-38-44-61-56-53-57(63-48-62-56)66(49-64-53)58-55-54(74-59(3,4)75-55)50(73-58)47-72-76(69,70)71/h48-50,54-55,58H,5-47H2,1-4H3,(H,60,67)(H,61,62,63)(H2,69,70,71)/t50-,54-,55-,58-/m0/s1 |
| InChIKey | FPJOZUAXPKSMQQ-BKUSHLRDSA-N |
| Mol Weight | 1090.5 g/mol |
| Molecular Formula | C59H108N7O9P |
| Exact Mass | 1089.794615 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HY3NPdm2AIj |
|---|---|
| Name | 2',3'-ISOPROPYLIDENE-N6-[((DIOCTADECYL)-AMINO)-SUCCINYL-AMINOHEXYL]-ADENOSINE-5'-MONOPHOSPHATE;DODA-HM-N6-AMP-AC |
| Compound Number | 15B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C59H106N7O9P |
| InChI | InChI=1S/C59H108N7O9P/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-35-39-45-65(46-40-36-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2)52(68)42-41-51(67)60-43-37-33-34-38-44-61-56-53-57(63-48-62-56)66(49-64-53)58-55-54(74-59(3,4)75-55)50(73-58)47-72-76(69,70)71/h48-50,54-55,58H,5-47H2,1-4H3,(H,60,67)(H,61,62,63)(H2,69,70,71)/t50-,54-,55-,58-/m0/s1 |
| InChIKey | FPJOZUAXPKSMQQ-BKUSHLRDSA-N |
| Literature Reference Author | L.SCHMITT,R.TAMPE |
| Literature Reference Citation | J.AM.CHEM.SOC.,118,5532(1996) |
| Literature Reference DOI | 10.1021/ja953937m |
| Solvent | CDCl3:CD3OD=3:1 |
| Source File Reference | UWLU55018 |