![C8-[((DIOCTADECYL)-AMINO)-SUCCINYL-AMINOETHYLAMINO]-ADENOSINE-5'-MONOPHOSPHATE;DODA-AE-C8-AMP](/api/spectrum/80PyuEnRMEN/structure.png?h=300&w=458 "C8-[((DIOCTADECYL)-AMINO)-SUCCINYL-AMINOETHYLAMINO]-ADENOSINE-5'-MONOPHOSPHATE;DODA-AE-C8-AMP")
| SpectraBase Compound ID | IpPVqFCqyu7 |
|---|---|
| InChI | InChI=1S/C52H97N8O9P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-39-59(40-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)45(62)36-35-44(61)54-37-38-55-52-58-46-49(53)56-42-57-50(46)60(52)51-48(64)47(63)43(69-51)41-68-70(65,66)67/h42-43,47-48,51,63-64H,3-41H2,1-2H3,(H,54,61)(H,55,58)(H2,53,56,57)(H2,65,66,67)/t43-,47-,48-,51-/m0/s1 |
| InChIKey | YULSOIMIZMDFRC-FDNBVBCQSA-N |
| Mol Weight | 1009.4 g/mol |
| Molecular Formula | C52H97N8O9P |
| Exact Mass | 1008.711614 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 80PyuEnRMEN |
|---|---|
| Name | C8-[((DIOCTADECYL)-AMINO)-SUCCINYL-AMINOETHYLAMINO]-ADENOSINE-5'-MONOPHOSPHATE;DODA-AE-C8-AMP |
| Compound Number | 13 A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C52H95N8O9P |
| InChI | InChI=1S/C52H97N8O9P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-39-59(40-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)45(62)36-35-44(61)54-37-38-55-52-58-46-49(53)56-42-57-50(46)60(52)51-48(64)47(63)43(69-51)41-68-70(65,66)67/h42-43,47-48,51,63-64H,3-41H2,1-2H3,(H,54,61)(H,55,58)(H2,53,56,57)(H2,65,66,67)/t43-,47-,48-,51-/m0/s1 |
| InChIKey | YULSOIMIZMDFRC-FDNBVBCQSA-N |
| Literature Reference Author | L.SCHMITT,R.TAMPE |
| Literature Reference Citation | J.AM.CHEM.SOC.,118,5532(1996) |
| Literature Reference DOI | 10.1021/ja953937m |
| Molecular Weight | 1007.348 g/mol |
| Sample ID | 55015 |
| Solvent | CDCl3:CD3OD=1:1 |