| SpectraBase Compound ID | 9lzc1A7VMUP |
|---|---|
| InChI | InChI=1S/C47H42N6O8/c1-31(54)49-45-50-42-40(43(51-45)61-46(56)53(37-20-12-6-13-21-37)38-22-14-7-15-23-38)48-30-52(42)44-41(60-32(2)55)33(28-58-44)29-59-47(34-16-8-4-9-17-34,35-18-10-5-11-19-35)36-24-26-39(57-3)27-25-36/h4-27,30,33,41,44H,28-29H2,1-3H3,(H,49,50,51,54)/t33-,41-,44-/m0/s1 |
| InChIKey | PIKMUNKJVTTYIC-LCPJFFRWSA-N |
| Mol Weight | 818.9 g/mol |
| Molecular Formula | C47H42N6O8 |
| Exact Mass | 818.306412 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AfVnElqNuEM |
|---|---|
| Name | 2-N-ACETYL-6-O-DIPHENYLCARBAMOYL-9-((1R,2R,3S)-TETRAHYDRO-2-ACETOXY-3-(((4-METHOXYPHENYL)-DIPHENYLMETHOXY)-METHYL)-1-FURANYL)-9H-GUANINE |
| Compound Number | 19A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C47H42N6O8 |
| InChI | InChI=1S/C47H42N6O8/c1-31(54)49-45-50-42-40(43(51-45)61-46(56)53(37-20-12-6-13-21-37)38-22-14-7-15-23-38)48-30-52(42)44-41(60-32(2)55)33(28-58-44)29-59-47(34-16-8-4-9-17-34,35-18-10-5-11-19-35)36-24-26-39(57-3)27-25-36/h4-27,30,33,41,44H,28-29H2,1-3H3,(H,49,50,51,54)/t33-,41-,44-/m0/s1 |
| InChIKey | PIKMUNKJVTTYIC-LCPJFFRWSA-N |
| Literature Reference Author | M.E.JUNG,A.TOYOTA,E.DECLERCQ,J.BALZARINI |
| Literature Reference Citation | MH.CHEM.,133,499(2002) |
| Literature Reference DOI | 10.1007/s007060200024 |
| Molecular Weight | 818.886 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWKP11515 |