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6'-O-PARA-COUMAROYL-8-EPIKINGISIDE
SpectraBase Compound ID 9rKvgbVNTJM
InChI InChI=1S/C26H30O13/c1-12-20-15(9-19(29)37-12)16(24(33)34-2)10-36-25(20)39-26-23(32)22(31)21(30)17(38-26)11-35-18(28)8-5-13-3-6-14(27)7-4-13/h3-8,10,12,15,17,20-23,25-27,30-32H,9,11H2,1-2H3/b8-5+/t12-,15-,17+,20-,21+,22-,23+,25+,26-/m1/s1
InChIKey ICIBBGBIPKDVNG-WCWFBWDKSA-N
Mol Weight 550.51 g/mol
Molecular Formula C26H30O13
Exact Mass 550.168641 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Dse19bJwAdp
Name 6'-O-TRANS-(PARA-COUMAROYL)-8-EPI-KINGISIDE
Compound Number 68
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H30O13
InChI InChI=1S/C26H30O13/c1-12-20-15(9-19(29)37-12)16(24(33)34-2)10-36-25(20)39-26-23(32)22(31)21(30)17(38-26)11-35-18(28)8-5-13-3-6-14(27)7-4-13/h3-8,10,12,15,17,20-23,25-27,30-32H,9,11H2,1-2H3/b8-5+/t12-,15-,17+,20-,21+,22-,23+,25+,26-/m1/s1
InChIKey ICIBBGBIPKDVNG-WCWFBWDKSA-N
Literature Reference Author B.DINDA,S.DEBNATH,Y.HARIGAYA
Literature Reference Citation CHEM.PHARM.BULL.,55,689(2007)
Literature Reference DOI 10.1248/cpb.55.689
Molecular Weight 550.516 g/mol
Sample ID 37480
Solvent CD3OD