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CHRYSOERIOL-7-O-[4''-O-(E)-COUMAROYL)-BETA-GLUCOPYRANOSIDE]

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CHRYSOERIOL-7-O-[4''-O-(E)-COUMAROYL)-BETA-GLUCOPYRANOSIDE]
SpectraBase Compound ID 3H4XDQDeGG
InChI InChI=1S/C31H28O13/c1-40-23-10-16(5-8-19(23)34)22-13-21(36)27-20(35)11-18(12-24(27)42-22)41-31-29(39)28(38)30(25(14-32)43-31)44-26(37)9-4-15-2-6-17(33)7-3-15/h2-13,25,28-35,38-39H,14H2,1H3/b9-4+/t25-,28-,29-,30-,31-/m1/s1
InChIKey XBOSNLUXROOJEU-HMDVYYKGSA-N
Mol Weight 608.55 g/mol
Molecular Formula C31H28O13
Exact Mass 608.152991 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8kYLsSfm1a1
Name CHRYSOERIOL-7-O-[4''-O-(E)-COUMAROYL)-BETA-GLUCOPYRANOSIDE]
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H28O13
InChI InChI=1S/C31H28O13/c1-40-23-10-16(5-8-19(23)34)22-13-21(36)27-20(35)11-18(12-24(27)42-22)41-31-29(39)28(38)30(25(14-32)43-31)44-26(37)9-4-15-2-6-17(33)7-3-15/h2-13,25,28-35,38-39H,14H2,1H3/b9-4+/t25-,28-,29-,30-,31-/m1/s1
InChIKey XBOSNLUXROOJEU-HMDVYYKGSA-N
Literature Reference Author C.RIVIERE,V.N.T.HONG,L.PIETERS,B.DEJAEGHER,Y.V.HEYDEN,M.C.VA N,J.QUETIN-LECLERCQ
Literature Reference Citation PHYTOCHEM.,70,86(2009)
Literature Reference DOI 10.1016/j.phytochem.2008.10.008
Molecular Weight 608.556 g/mol
Sample ID 63921
Solvent CD3OD