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WITHALONGOLIDE_J;28-O-BETA-D-GLUCOPYRANOSYL-1-ALPHA,3-BETA,19-TRIHYDROXYWITHA-5,24-DIENOLIDE
SpectraBase Compound ID L5QLpDBpodQ
InChI InChI=1S/C34H52O11/c1-16-18(14-43-32-30(41)29(40)28(39)26(13-35)45-32)10-25(44-31(16)42)17(2)22-6-7-23-21-5-4-19-11-20(37)12-27(38)34(19,15-36)24(21)8-9-33(22,23)3/h4,17,20-30,32,35-41H,5-15H2,1-3H3/t17-,20+,21-,22+,23-,24-,25+,26+,27-,28+,29-,30+,32+,33+,34-/m0/s1
InChIKey JDYYLQIQTRWVFW-ILJUDCBVSA-N
Mol Weight 636.8 g/mol
Molecular Formula C34H52O11
Exact Mass 636.350962 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DC50LrDzHe5
Name WITHALONGOLIDE_J;28-O-BETA-D-GLUCOPYRANOSYL-1-ALPHA,3-BETA,19-TRIHYDROXYWITHA-5,24-DIENOLIDE
Compound Number 10
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H52O11
InChI InChI=1S/C34H52O11/c1-16-18(14-43-32-30(41)29(40)28(39)26(13-35)45-32)10-25(44-31(16)42)17(2)22-6-7-23-21-5-4-19-11-20(37)12-27(38)34(19,15-36)24(21)8-9-33(22,23)3/h4,17,20-30,32,35-41H,5-15H2,1-3H3/t17-,20+,21-,22+,23-,24-,25+,26+,27-,28+,29-,30+,32+,33+,34-/m0/s1
InChIKey JDYYLQIQTRWVFW-ILJUDCBVSA-N
Literature Reference Author H.ZHANG,A.K.SAMADI,R.J.GALLAGHER,J.J.ARAYA,X.TONG,V.W.DAY,M. S.COHEN,K.KINDSCHER,
Literature Reference Citation J.NAT.PROD.,74,2532(2011)
Literature Reference DOI 10.1021/np200635r
Molecular Weight 636.780 g/mol
Sample ID 39638
Solvent C5D5N