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ICARISIDE-D(1)-HEXAACETATE

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ICARISIDE-D(1)-HEXAACETATE
SpectraBase Compound ID K5yKZ5AVJDg
InChI InChI=1S/C31H40O16/c1-17(32)40-15-31(47-22(6)37)16-41-30(28(31)45-21(5)36)39-14-24-25(42-18(2)33)26(43-19(3)34)27(44-20(4)35)29(46-24)38-13-12-23-10-8-7-9-11-23/h7-11,24-30H,12-16H2,1-6H3/t24-,25-,26+,27-,28-,29-,30+,31+/m0/s1
InChIKey YVIVLTYSVYTAND-KWJNIICQSA-N
Mol Weight 668.6 g/mol
Molecular Formula C31H40O16
Exact Mass 668.231635 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JAHD7i0AnSS
Name ICARISIDE-D(1)-HEXAACETATE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H40O16
InChI InChI=1S/C31H40O16/c1-17(32)40-15-31(47-22(6)37)16-41-30(28(31)45-21(5)36)39-14-24-25(42-18(2)33)26(43-19(3)34)27(44-20(4)35)29(46-24)38-13-12-23-10-8-7-9-11-23/h7-11,24-30H,12-16H2,1-6H3/t24-,25-,26+,27-,28-,29-,30+,31+/m0/s1
InChIKey YVIVLTYSVYTAND-KWJNIICQSA-N
Literature Reference Author N.H.ANH,H.RIPPERGER,A.PORZEL,T.V.SUNG,G.ADAM
Literature Reference Citation PHYTOCHEM.,46,569(1997)
Literature Reference DOI 10.1016/s0031-9422(97)00209-4
Molecular Weight 668.649 g/mol
Sample ID 45457
Solvent CDCl3