![6-N-[(DI-N-BUTYLAMINO)-METHYLENE]-3'-[N-(9-FLUORENYL)-METHOXYCARBONYL-L-ALANYLAMINO]-3'-DEOXY-BETA-D-ADENOSINE](/api/spectrum/ImamLECOlei/structure.png?h=300&w=458 "6-N-[(DI-N-BUTYLAMINO)-METHYLENE]-3'-[N-(9-FLUORENYL)-METHOXYCARBONYL-L-ALANYLAMINO]-3'-DEOXY-BETA-D-ADENOSINE")
| SpectraBase Compound ID | KMgqBmbsyzs |
|---|---|
| InChI | InChI=1S/C37H46N8O6/c1-4-6-16-44(17-7-5-2)21-41-33-31-34(39-20-38-33)45(22-40-31)36-32(47)30(29(18-46)51-36)43-35(48)23(3)42-37(49)50-19-28-26-14-10-8-12-24(26)25-13-9-11-15-27(25)28/h8-15,20-23,28-30,32,36,46-47H,4-7,16-19H2,1-3H3,(H,42,49)(H,43,48)/b41-21+/t23-,29+,30+,32+,36+/m0/s1 |
| InChIKey | QXQRGECDEUSXLC-FXGRXERSSA-N |
| Mol Weight | 698.8 g/mol |
| Molecular Formula | C37H46N8O6 |
| Exact Mass | 698.354031 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ImamLECOlei |
|---|---|
| Name | 6-N-[(DI-N-BUTYLAMINO)-METHYLENE]-3'-[N-(9-FLUORENYL)-METHOXYCARBONYL-L-ALANYLAMINO]-3'-DEOXY-BETA-D-ADENOSINE |
| Compound Number | 13A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H46N8O6 |
| InChI | InChI=1S/C37H46N8O6/c1-4-6-16-44(17-7-5-2)21-41-33-31-34(39-20-38-33)45(22-40-31)36-32(47)30(29(18-46)51-36)43-35(48)23(3)42-37(49)50-19-28-26-14-10-8-12-24(26)25-13-9-11-15-27(25)28/h8-15,20-23,28-30,32,36,46-47H,4-7,16-19H2,1-3H3,(H,42,49)(H,43,48)/b41-21+/t23-,29+,30+,32+,36+/m0/s1 |
| InChIKey | QXQRGECDEUSXLC-FXGRXERSSA-N |
| Literature Reference Author | N.Q.NGUYEN-TRUNG,O.BOTTA,S.TERENZI,P.STRAZEWSKI |
| Literature Reference Citation | J.ORG.CHEM.,68,2038(2003) |
| Literature Reference DOI | 10.1021/jo026627c |
| Molecular Weight | 698.822 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN25615 |