SpectraBase Compound ID | 5d2mEEKDM42 |
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InChI | InChI=1S/C31H52O10/c1-7-8-9-10-11-12-15-30(4)18-24(32)20(2)13-14-22-16-23(17-31(35,40-22)19-25(33)41-30)39-29-28(37-6)26(34)27(36-5)21(3)38-29/h8-11,20-24,26-29,32,34-35H,7,12-19H2,1-6H3/b9-8+,11-10+/t20-,21-,22+,23-,24+,26+,27-,28+,29-,30-,31+/m0/s1 |
InChIKey | YYWHCGARYFKWST-ZQWMMJQUSA-N |
Mol Weight | 584.7 g/mol |
Molecular Formula | C31H52O10 |
Exact Mass | 584.356048 g/mol |
SpectraBase Spectrum ID | DEaU8IYp6vV |
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Name | LYNGBOUILLOSIDE |
Compound Number | 1 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C31H52O10 |
InChI | InChI=1S/C31H52O10/c1-7-8-9-10-11-12-15-30(4)18-24(32)20(2)13-14-22-16-23(17-31(35,40-22)19-25(33)41-30)39-29-28(37-6)26(34)27(36-5)21(3)38-29/h8-11,20-24,26-29,32,34-35H,7,12-19H2,1-6H3/b9-8+,11-10+/t20-,21-,22+,23-,24+,26+,27-,28+,29-,30-,31+/m0/s1 |
InChIKey | YYWHCGARYFKWST-ZQWMMJQUSA-N |
Literature Reference Author | L.T.TAN,B.L.MARQUEZ,W.H.GERWICK |
Literature Reference Citation | J.NAT.PROD.,65,925(2002) |
Literature Reference DOI | 10.1021/np010526c |
Molecular Weight | 584.748 g/mol |
Solvent | CDCl3 |
Source File Reference | UWSI6114 |