| SpectraBase Compound ID | KiO0btjbWSh |
|---|---|
| InChI | InChI=1S/C21H28O9/c1-7-4-12(28-21-18(26)17(25)16(24)13(6-22)29-21)15-9(3)20(27)30-19(15)14-8(2)11(23)5-10(7)14/h10-19,21-26H,1-6H2/t10-,11-,12-,13-,14-,15+,16-,17+,18-,19+,21-/m0/s1 |
| InChIKey | YWRYYBZVPGQDQS-WAQSKWDYSA-N |
| Mol Weight | 424.45 g/mol |
| Molecular Formula | C21H28O9 |
| Exact Mass | 424.173332 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | J2KxUrp1WHd |
|---|---|
| Name | 3-BETA-HYDROXY-4(15),10(14),11(13)-GUAIA-TRIEN-12,6-OLIDE-8-ALPHA-O-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H28O9 |
| InChI | InChI=1S/C21H28O9/c1-7-4-12(28-21-18(26)17(25)16(24)13(6-22)29-21)15-9(3)20(27)30-19(15)14-8(2)11(23)5-10(7)14/h10-19,21-26H,1-6H2/t10-,11-,12-,13-,14-,15+,16-,17+,18-,19+,21-/m0/s1 |
| InChIKey | YWRYYBZVPGQDQS-WAQSKWDYSA-N |
| Literature Reference Author | W.CHANGZENG,Y.DEQUAN |
| Literature Reference Citation | PHYTOCHEM.,45,1483(1997) |
| Literature Reference DOI | 10.1016/S0031-9422(97)00156-8 |
| Molecular Weight | 424.448 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWSP611 |