| SpectraBase Compound ID | 9xguQSGAsAj |
|---|---|
| InChI | InChI=1S/C22H28O11/c1-22(2,28)15-5-10-12(32-15)6-13-16(20(10)29-3)11(24)4-9(31-13)8-30-21-19(27)18(26)17(25)14(7-23)33-21/h4,6,14-15,17-19,21,23,25-28H,5,7-8H2,1-3H3/t14-,15?,17-,18+,19-,21-/m0/s1 |
| InChIKey | XIUVHOSBSDYXRG-BEKZKUGTSA-N |
| Mol Weight | 468.46 g/mol |
| Molecular Formula | C22H28O11 |
| Exact Mass | 468.163162 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1qbjNHuppKe |
|---|---|
| Name | CIMIFUGIN-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H28O11 |
| InChI | InChI=1S/C22H28O11/c1-22(2,28)15-5-10-12(32-15)6-13-16(20(10)29-3)11(24)4-9(31-13)8-30-21-19(27)18(26)17(25)14(7-23)33-21/h4,6,14-15,17-19,21,23,25-28H,5,7-8H2,1-3H3/t14-,15?,17-,18+,19-,21-/m0/s1 |
| InChIKey | XIUVHOSBSDYXRG-BEKZKUGTSA-N |
| Literature Reference Author | B.KOPP,E.KUBELKA,C.REICH,W.ROBIEN,W.KUBELKA |
| Literature Reference Citation | HELV.CHIM.ACTA,74,611(1991) |
| Literature Reference DOI | 10.1002/hlca.19910740318 |
| Molecular Weight | 468.458 g/mol |
| Solvent | CDCl3:CD3OD=1:1 |
| Source File Reference | UWVP5965 |