| SpectraBase Compound ID | 54WLG2g6Cty |
|---|---|
| InChI | InChI=1S/C27H36O16/c1-12(28)36-10-20-22(39-15(4)31)23(40-16(5)32)24(41-17(6)33)26(42-20)43-25-21-18(7-8-35-25)19(38-14(3)30)9-27(21,34)11-37-13(2)29/h7-8,18-26,34H,9-11H2,1-6H3/t18?,19?,20-,21?,22-,23+,24-,25?,26+,27?/m0/s1 |
| InChIKey | YKWHBSSEQIKWQI-LUGKVQRXSA-N |
| Mol Weight | 616.6 g/mol |
| Molecular Formula | C27H36O16 |
| Exact Mass | 616.200335 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EtxOUoGm2BR |
|---|---|
| Name | 5,7-Bisdeoxy-cynanchoside hexaacetate |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C27H36O16 |
| InChI | InChI=1S/C27H36O16/c1-12(28)36-10-20-22(39-15(4)31)23(40-16(5)32)24(41-17(6)33)26(42-20)43-25-21-18(7-8-35-25)19(38-14(3)30)9-27(21,34)11-37-13(2)29/h7-8,18-26,34H,9-11H2,1-6H3/t18?,19?,20-,21?,22-,23+,24-,25?,26+,27?/m0/s1 |
| InChIKey | YKWHBSSEQIKWQI-LUGKVQRXSA-N |
| Literature Reference | C. Adriani, C. Iavarone, Phytochem. 21, 231 (1982). |
| NMR Standard | Dioxane |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |