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1,3,6,2',3',4',6',4''-O-OCTAACETYL-3-O-TRANS-PARA-COUMAROYLSUCROSE

View entire compound with spectra: 1 NMR

1,3,6,2',3',4',6',4''-O-OCTAACETYL-3-O-TRANS-PARA-COUMAROYLSUCROSE
SpectraBase Compound ID 7yClN1OLUWf
InChI InChI=1S/C37H44O21/c1-18(38)47-15-28-31(51-22(5)42)33(53-24(7)44)34(54-25(8)45)36(55-28)58-37(17-49-20(3)40)35(32(52-23(6)43)29(57-37)16-48-19(2)39)56-30(46)14-11-26-9-12-27(13-10-26)50-21(4)41/h9-14,28-29,31-36H,15-17H2,1-8H3/b14-11+/t28-,29-,31-,32-,33+,34-,35+,36-,37+/m1/s1
InChIKey NBJYHKAHAORKDW-XSUWDTPUSA-N
Mol Weight 824.7 g/mol
Molecular Formula C37H44O21
Exact Mass 824.237508 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Hbhi6Sytq9I
Name 1,3,6,2',3',4',6',4''-O-OCTAACETYL-3-O-TRANS-PARA-COUMAROYLSUCROSE
Compound Number 4A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H44O21
InChI InChI=1S/C37H44O21/c1-18(38)47-15-28-31(51-22(5)42)33(53-24(7)44)34(54-25(8)45)36(55-28)58-37(17-49-20(3)40)35(32(52-23(6)43)29(57-37)16-48-19(2)39)56-30(46)14-11-26-9-12-27(13-10-26)50-21(4)41/h9-14,28-29,31-36H,15-17H2,1-8H3/b14-11+/t28-,29-,31-,32-,33+,34-,35+,36-,37+/m1/s1
InChIKey NBJYHKAHAORKDW-XSUWDTPUSA-N
Literature Reference Author N.SHIMAZAKI,Y.MIMAKI,Y.SASHIDA
Literature Reference Citation PHYTOCHEM.,30,1475(1991)
Literature Reference DOI 10.1016/0031-9422(91)84190-4
Molecular Weight 824.744 g/mol
Solvent CDCl3
Source File Reference UWLU34336