SpectraBase Compound ID | 98GBprvDtJ0 |
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InChI | InChI=1S/C21H36O9/c1-9-5-11(28-18-17(26)16(25)15(24)12(8-22)29-18)14-10(9)6-21(27)13(23)7-20(14,4)30-19(21,2)3/h9-18,22-27H,5-8H2,1-4H3/t9-,10-,11+,12+,13-,14-,15+,16-,17+,18+,20+,21+/m1/s1 |
InChIKey | SPYAOTULQPJFGN-XBOJPXMNSA-N |
Mol Weight | 432.5 g/mol |
Molecular Formula | C21H36O9 |
Exact Mass | 432.235933 g/mol |
SpectraBase Spectrum ID | Le5GZSDJRhx |
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Name | 2-ALPHA,7-ALPHA,8-BETA-TRIHYDROXYKESSANE-2-O-BETA-D-GLUCOPYRANOSIDE |
Compound Number | 6 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C21H36O9 |
InChI | InChI=1S/C21H36O9/c1-9-5-11(28-18-17(26)16(25)15(24)12(8-22)29-18)14-10(9)6-21(27)13(23)7-20(14,4)30-19(21,2)3/h9-18,22-27H,5-8H2,1-4H3/t9-,10-,11+,12+,13-,14-,15+,16-,17+,18+,20+,21+/m1/s1 |
InChIKey | SPYAOTULQPJFGN-XBOJPXMNSA-N |
Literature Reference Author | J.KITAJIMA,N.SUZUKI,Y.TANAKA |
Literature Reference Citation | CHEM.PHARM.BULL.,46,1743(1998) |
Literature Reference DOI | 10.1248/cpb.46.1743 |
Molecular Weight | 432.511 g/mol |
Solvent | CDCl3 |
Source File Reference | UWMS20807 |