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DODEGRANOSIDE-D;3-[7-HYDROXY-6-[4'''-HYDROXY-3'''-(O-BETA-D-GLUCOPYRANOSYL)-PHENOXY]-PHENYL]-ACRYLIC-ACID-1'-(2''-HYDROXYPHENOXY)-BETA-D-GLUCOPYRANOSY
SpectraBase Compound ID LvHtqQTpDQL
InChI InChI=1S/C33H36O17/c34-13-23-26(39)28(41)30(43)33(49-23)48-22-12-16(7-9-19(22)37)46-21-11-15(5-8-18(21)36)6-10-25(38)45-14-24-27(40)29(42)31(44)32(50-24)47-20-4-2-1-3-17(20)35/h1-12,23-24,26-37,39-44H,13-14H2/b10-6+/t23-,24+,26-,27+,28+,29-,30-,31+,32+,33-/m1/s1
InChIKey JZAFSPMBEHWTTO-JSBWYCLGSA-N
Mol Weight 704.6 g/mol
Molecular Formula C33H36O17
Exact Mass 704.19525 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Iat4ub5msNO
Name DODEGRANOSIDE-D;3-[7-HYDROXY-6-[4'''-HYDROXY-3'''-(O-BETA-D-GLUCOPYRANOSYL)-PHENOXY]-PHENYL]-ACRYLIC-ACID-1'-(2''-HYDROXYPHENOXY)-BETA-D-GLUCOPYRANOSY
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H36O17
InChI InChI=1S/C33H36O17/c34-13-23-26(39)28(41)30(43)33(49-23)48-22-12-16(7-9-19(22)37)46-21-11-15(5-8-18(21)36)6-10-25(38)45-14-24-27(40)29(42)31(44)32(50-24)47-20-4-2-1-3-17(20)35/h1-12,23-24,26-37,39-44H,13-14H2/b10-6+/t23-,24+,26-,27+,28+,29-,30-,31+,32+,33-/m1/s1
InChIKey JZAFSPMBEHWTTO-JSBWYCLGSA-N
Literature Reference Author M.KUMAR,P.RAWAT,N.RAHUJA,A.K.SRIVASTAVA,R.MAURYA
Literature Reference Citation PHYTOCHEM.,70,1448(2009)
Literature Reference DOI 10.1016/j.phytochem.2009.07.029
Molecular Weight 704.639 g/mol
Sample ID 45651
Solvent CD3OD