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DAIDZIN-7-O-BETA-D-(6''-O-METHYLMALONYL)-GLUCOSIDE
SpectraBase Compound ID 1DN1aoXqFuZ
InChI InChI=1S/C25H24O12/c1-33-19(27)9-20(28)35-11-18-22(30)23(31)24(32)25(37-18)36-14-6-7-15-17(8-14)34-10-16(21(15)29)12-2-4-13(26)5-3-12/h2-8,10,18,22-26,30-32H,9,11H2,1H3/t18-,22-,23+,24-,25-/m0/s1
InChIKey XHGPZYHGIJWAEZ-XJTSNBOBSA-N
Mol Weight 516.46 g/mol
Molecular Formula C25H24O12
Exact Mass 516.126776 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1WYAdiJbdSx
Name DAIDZIN-7-O-BETA-D-(6''-O-METHYLMALONYL)-GLUCOSIDE
Compound Number 3A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H24O12
InChI InChI=1S/C25H24O12/c1-33-19(27)9-20(28)35-11-18-22(30)23(31)24(32)25(37-18)36-14-6-7-15-17(8-14)34-10-16(21(15)29)12-2-4-13(26)5-3-12/h2-8,10,18,22-26,30-32H,9,11H2,1H3/t18-,22-,23+,24-,25-/m0/s1
InChIKey XHGPZYHGIJWAEZ-XJTSNBOBSA-N
Literature Reference Author K.HIRAKURA,M.MORITA,K.NAKAJIMA,K.SUGAMA,K.TAKAGI,K.NIITSU,Y. IKEYA,M.MARUNO,M.OKA
Literature Reference Citation PHYTOCHEM.,46,921(1997)
Literature Reference DOI 10.1016/s0031-9422(97)00371-3
Molecular Weight 516.458 g/mol
Sample ID 45475
Solvent ACETONE-D6