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5,6,7,4'-TETRAHYDROXYFLAVONE-7-O-[6''-O-(E)-CAFFEOYL]-BETA-GLUCOPYRANOSIDE

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5,6,7,4'-TETRAHYDROXYFLAVONE-7-O-[6''-O-(E)-CAFFEOYL]-BETA-GLUCOPYRANOSIDE
SpectraBase Compound ID 1swxyoiUU4U
InChI InChI=1S/C30H26O14/c31-15-5-3-14(4-6-15)19-10-18(34)24-20(42-19)11-21(25(36)27(24)38)43-30-29(40)28(39)26(37)22(44-30)12-41-23(35)8-2-13-1-7-16(32)17(33)9-13/h1-11,22,26,28-33,36-40H,12H2/b8-2+/t22-,26-,28+,29-,30-/m1/s1
InChIKey PMQFRYOUROAMMQ-SKIKXBICSA-N
Mol Weight 610.52 g/mol
Molecular Formula C30H26O14
Exact Mass 610.132256 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5qqnR2usETA
Name 5,6,7,4'-TETRAHYDROXYFLAVONE-7-O-[6''-O-(E)-CAFFEOYL]-BETA-GLUCOPYRANOSIDE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H26O14
InChI InChI=1S/C30H26O14/c31-15-5-3-14(4-6-15)19-10-18(34)24-20(42-19)11-21(25(36)27(24)38)43-30-29(40)28(39)26(37)22(44-30)12-41-23(35)8-2-13-1-7-16(32)17(33)9-13/h1-11,22,26,28-33,36-40H,12H2/b8-2+/t22-,26-,28+,29-,30-/m1/s1
InChIKey PMQFRYOUROAMMQ-SKIKXBICSA-N
Literature Reference Author Y.MENG,A.J.KRZYSIAK,M.J.DURAKO,J.I.KUNZELMAN,J.L.C.WRIGHT
Literature Reference Citation PHYTOCHEM.,69,2603(2008)
Literature Reference DOI 10.1016/j.phytochem.2008.07.007
Molecular Weight 610.528 g/mol
Sample ID 63177
Solvent DMSO-D6