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SHOGASULFONIC-ACID-D;5-SULFONYL-1,7-BIS-(4,5-DIHYDROXY-3-METHOXYPHENYL)-HEPTAN-3-ONE
SpectraBase Compound ID 8NbFheLAeSq
InChI InChI=1S/C21H26O10S/c1-30-18-9-12(7-16(23)20(18)25)3-5-14(22)11-15(32(27,28)29)6-4-13-8-17(24)21(26)19(10-13)31-2/h7-10,15,23-26H,3-6,11H2,1-2H3,(H,27,28,29)
InChIKey ZKNBKMKBFDAWTE-UHFFFAOYSA-N
Mol Weight 470.49 g/mol
Molecular Formula C21H26O10S
Exact Mass 470.124668 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C6AWA37OMJ0
Name SHOGASULFONIC-ACID-D;5-SULFONYL-1,7-BIS-(4,5-DIHYDROXY-3-METHOXYPHENYL)-HEPTAN-3-ONE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H26O10S
InChI InChI=1S/C21H26O10S/c1-30-18-9-12(7-16(23)20(18)25)3-5-14(22)11-15(32(27,28)29)6-4-13-8-17(24)21(26)19(10-13)31-2/h7-10,15,23-26H,3-6,11H2,1-2H3,(H,27,28,29)
InChIKey ZKNBKMKBFDAWTE-UHFFFAOYSA-N
Literature Reference Author Y.HORI,T.MIURA,Y.HIRAI,M.FUKUMURA,Y.NEMOTO,K.TORIIZUKA,Y.IDA
Literature Reference Citation PHYTOCHEM.,62,613(2003)
Literature Reference DOI 10.1016/S0031-9422(02)00618-0
Molecular Weight 470.491 g/mol
Solvent CD3OD
Source File Reference UWVN26887