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2-(3,4-DIHYDROXYPHENYL)-5,7-DIHYDROXY-4-OXO-4-H-CHROMEN-3-YL-4,6-BIS-O-BETA-D-(3,4,5-TRIHYDROXYBENZOYL)-GLUCOPYRANOSIDE
SpectraBase Compound ID ECCsVvf5Ia9
InChI InChI=1S/C35H28O20/c36-14-8-17(39)24-22(9-14)52-30(11-1-2-15(37)16(38)3-11)32(27(24)46)55-35-29(48)28(47)31(54-34(50)13-6-20(42)26(45)21(43)7-13)23(53-35)10-51-33(49)12-4-18(40)25(44)19(41)5-12/h1-9,23,28-29,31,35-45,47-48H,10H2/t23-,28-,29-,31-,35+/m1/s1
InChIKey MRUQVWOQCMKJPB-XFZVVQBLSA-N
Mol Weight 768.6 g/mol
Molecular Formula C35H28O20
Exact Mass 768.117393 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HwdvI7vfoor
Name 2-(3,4-DIHYDROXYPHENYL)-5,7-DIHYDROXY-4-OXO-4-H-CHROMEN-3-YL-4,6-BIS-O-BETA-D-(3,4,5-TRIHYDROXYBENZOYL)-GLUCOPYRANOSIDE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H28O20
InChI InChI=1S/C35H28O20/c36-14-8-17(39)24-22(9-14)52-30(11-1-2-15(37)16(38)3-11)32(27(24)46)55-35-29(48)28(47)31(54-34(50)13-6-20(42)26(45)21(43)7-13)23(53-35)10-51-33(49)12-4-18(40)25(44)19(41)5-12/h1-9,23,28-29,31,35-45,47-48H,10H2/t23-,28-,29-,31-,35+/m1/s1
InChIKey MRUQVWOQCMKJPB-XFZVVQBLSA-N
Literature Reference Author A.A.HUSSEIN,I.BARBERENA,M.CORREA,P.D.COLEY,P.N.SOLIS,M.P.GUP TA
Literature Reference Citation J.NAT.PROD.,68,231(2005)
Literature Reference DOI 10.1021/np049803g
Molecular Weight 768.595 g/mol
Solvent CD3OD
Source File Reference UWMZ9035