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3',4'-di-O-methylquercetin-7-O-[(4''->13''')-2''',6''',10''',14'''-tetramethylhexadec-13'''-ol-14'''-enyl]-.beta.-D-glucopyranoside

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3',4'-di-O-methylquercetin-7-O-[(4''->13''')-2''',6''',10''',14'''-tetramethylhexadec-13'''-ol-14'''-enyl]-.beta.-D-glucopyranoside
SpectraBase Compound ID 2qFbSKUoN3D
InChI InChI=1S/C43H62O12/c1-9-27(6)31(18-16-26(5)15-11-14-25(4)13-10-12-24(2)3)53-42-35(23-44)55-43(40(49)39(42)48)52-29-21-30(45)36-34(22-29)54-41(38(47)37(36)46)28-17-19-32(50-7)33(20-28)51-8/h9,17,19-22,24-26,31,35,39-40,42-45,47-49H,10-16,18,23H2,1-8H3/b27-9+/t25?,26?,31?,35-,39-,40-,42-,43-/m1/s1
InChIKey NJNVTGXVNWOETM-YDYICKJWSA-N
Mol Weight 771.0 g/mol
Molecular Formula C43H62O12
Exact Mass 770.424127 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3ucKhUos5VN
Name 3',4'-DI-O-METHYLQUERCETIN-7-O-[(4''->13''')-2''',6''',10''',14'''-TETRAMETHYLHEXADEC-13'''-OL-14'''-ENYL]-BETA-D-GLUCOPYRANOSIDE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C43H62O12
InChI InChI=1S/C43H62O12/c1-9-27(6)31(18-16-26(5)15-11-14-25(4)13-10-12-24(2)3)53-42-35(23-44)55-43(40(49)39(42)48)52-29-21-30(45)36-34(22-29)54-41(38(47)37(36)46)28-17-19-32(50-7)33(20-28)51-8/h9,17,19-22,24-26,31,35,39-40,42-45,47-49H,10-16,18,23H2,1-8H3/b27-9+/t25?,26?,31?,35-,39-,40-,42-,43-/m1/s1
InChIKey NJNVTGXVNWOETM-YDYICKJWSA-N
Literature Reference Author I.M.CHUNG,A.AHMAD,M.ALI,O.K.LEE,M.Y.KIM,J.H.KIM,D.Y.YOON,C.A .M.PEEBLES,K.Y.SAN
Literature Reference Citation J.NAT.PROD.,72,613(2009)
Literature Reference DOI 10.1021/np800378q
Molecular Weight 770.958 g/mol
Sample ID 32350
Solvent CD3OD