| SpectraBase Compound ID | 9OdmNTdKhEC |
|---|---|
| InChI | InChI=1S/C35H50N2O9/c1-6-20-17-36-9-7-21-13-29(42-2)31(44-4)15-24(21)26(36)11-23(20)12-27-25-16-32(45-5)30(43-3)14-22(25)8-10-37(27)19-35(41)34(40)33(39)28(38)18-46-35/h13-16,20,23,26-28,33-34,38-41H,6-12,17-19H2,1-5H3/t20-,23+,26-,27-,28+,33+,34-,35+/m0/s1 |
| InChIKey | HUQQRFBRVADSEA-KQBDIZQJSA-N |
| Mol Weight | 642.8 g/mol |
| Molecular Formula | C35H50N2O9 |
| Exact Mass | 642.351631 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4aME1jAqEqJ |
|---|---|
| Name | 2'-N-(1''-DEOXY-1''-BETA-D-FRUCTOPYRANOSYL)-EMETINE |
| Compound Number | 14 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H50N2O9 |
| InChI | InChI=1S/C35H50N2O9/c1-6-20-17-36-9-7-21-13-29(42-2)31(44-4)15-24(21)26(36)11-23(20)12-27-25-16-32(45-5)30(43-3)14-22(25)8-10-37(27)19-35(41)34(40)33(39)28(38)18-46-35/h13-16,20,23,26-28,33-34,38-41H,6-12,17-19H2,1-5H3/t20-,23+,26-,27-,28+,33+,34-,35+/m0/s1 |
| InChIKey | HUQQRFBRVADSEA-KQBDIZQJSA-N |
| Literature Reference Author | A.ITOH,Y.IKUTA,Y.BABA,T.TANAHASHI,N.NAGAKURA |
| Literature Reference Citation | PHYTOCHEM.,52,1169(1999) |
| Literature Reference DOI | 10.1016/S0031-9422(99)00361-1 |
| Molecular Weight | 642.790 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN402 |