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ISORHAMNETIN-3-O-(6''-O-E-FERULOYL)-NEOHESPERIDOSIDE
SpectraBase Compound ID JQpDDyPP5Yc
InChI InChI=1S/C38H40O19/c1-15-28(44)31(47)33(49)37(53-15)57-36-32(48)29(45)25(14-52-26(43)9-5-16-4-7-19(40)22(10-16)50-2)55-38(36)56-35-30(46)27-21(42)12-18(39)13-24(27)54-34(35)17-6-8-20(41)23(11-17)51-3/h4-13,15,25,28-29,31-33,36-42,44-45,47-49H,14H2,1-3H3/b9-5+/t15-,25+,28-,29+,31+,32-,33+,36+,37-,38-/m1/s1
InChIKey FZMZTQDLCZCIPI-MGJACCOPSA-N
Mol Weight 800.7 g/mol
Molecular Formula C38H40O19
Exact Mass 800.216379 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GIZGNwibHAC
Name ISORHAMNETIN-3-O-(6''-O-E-FERULOYL)-NEOHESPERIDOSIDE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C38H40O19
InChI InChI=1S/C38H40O19/c1-15-28(44)31(47)33(49)37(53-15)57-36-32(48)29(45)25(14-52-26(43)9-5-16-4-7-19(40)22(10-16)50-2)55-38(36)56-35-30(46)27-21(42)12-18(39)13-24(27)54-34(35)17-6-8-20(41)23(11-17)51-3/h4-13,15,25,28-29,31-33,36-42,44-45,47-49H,14H2,1-3H3/b9-5+/t15-,25+,28-,29+,31+,32-,33+,36+,37-,38-/m1/s1
InChIKey FZMZTQDLCZCIPI-MGJACCOPSA-N
Literature Reference Author M.SALEEM,H.J.KIM,C.K.HAN,C.JIN,Y.S.LEE
Literature Reference Citation PHYTOCHEM.,67,1390(2006)
Literature Reference DOI 10.1016/j.phytochem.2006.04.009
Molecular Weight 800.724 g/mol
Sample ID 67050
Solvent CD3OD