For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
DODEGRANOSIDE-D-PERACETATE;3-[7-ACETOXY-6-[4'''-ACETOXY-3'''-[TETRAACECYL-(O-BETA-D-GLUCOPYRANOSYL)]-PHENOXY]-PHENYL]-ACRYLIC-ACID-1'-(2''ACETOXYPHEN
SpectraBase Compound ID K1Jf3zahW3W
InChI InChI=1S/C53H56O27/c1-25(54)65-23-43-46(70-29(5)58)48(72-31(7)60)51(75-34(10)63)53(79-43)78-42-22-36(17-19-40(42)69-28(4)57)76-41-21-35(15-18-39(41)68-27(3)56)16-20-45(64)66-24-44-47(71-30(6)59)49(73-32(8)61)50(74-33(9)62)52(80-44)77-38-14-12-11-13-37(38)67-26(2)55/h11-22,43-44,46-53H,23-24H2,1-10H3/b20-16+/t43-,44-,46-,47-,48+,49+,50-,51-,52-,53-/m1/s1
InChIKey FAVNOYKOTNGKOI-JRWCASINSA-N
Mol Weight 1125.0 g/mol
Molecular Formula C53H56O27
Exact Mass 1124.300897 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID IdDzf12edAg
Name DODEGRANOSIDE-D-PERACETATE;3-[7-ACETOXY-6-[4'''-ACETOXY-3'''-[TETRAACECYL-(O-BETA-D-GLUCOPYRANOSYL)]-PHENOXY]-PHENYL]-ACRYLIC-ACID-1'-(2''ACETOXYPHEN
Compound Number 4A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C53H56O27
InChI InChI=1S/C53H56O27/c1-25(54)65-23-43-46(70-29(5)58)48(72-31(7)60)51(75-34(10)63)53(79-43)78-42-22-36(17-19-40(42)69-28(4)57)76-41-21-35(15-18-39(41)68-27(3)56)16-20-45(64)66-24-44-47(71-30(6)59)49(73-32(8)61)50(74-33(9)62)52(80-44)77-38-14-12-11-13-37(38)67-26(2)55/h11-22,43-44,46-53H,23-24H2,1-10H3/b20-16+/t43-,44-,46-,47-,48+,49+,50-,51-,52-,53-/m1/s1
InChIKey FAVNOYKOTNGKOI-JRWCASINSA-N
Literature Reference Author M.KUMAR,P.RAWAT,N.RAHUJA,A.K.SRIVASTAVA,R.MAURYA
Literature Reference Citation PHYTOCHEM.,70,1448(2009)
Literature Reference DOI 10.1016/j.phytochem.2009.07.029
Molecular Weight 1125.011 g/mol
Sample ID 45652
Solvent CDCl3