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HEPTA-4,6-DIYNE-1,3-DIOL-1-O-BETA-D-GLUCOPYRANOSIDE-PENTAACETATE
SpectraBase Compound ID DXGSiYSk1of
InChI InChI=1S/C23H28O12/c1-7-8-9-18(31-14(3)25)10-11-29-23-22(34-17(6)28)21(33-16(5)27)20(32-15(4)26)19(35-23)12-30-13(2)24/h1,18-23H,10-12H2,2-6H3/t18?,19-,20-,21+,22-,23-/m0/s1
InChIKey JLCGNCQVVIUWFN-RWCPEOFKSA-N
Mol Weight 496.47 g/mol
Molecular Formula C23H28O12
Exact Mass 496.158076 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B4AjdBKAbGz
Name HEPTA-4,6-DIYNE-1,3-DIOL-1-O-BETA-D-GLUCOPYRANOSIDE-PENTAACETATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H28O12
InChI InChI=1S/C23H28O12/c1-7-8-9-18(31-14(3)25)10-11-29-23-22(34-17(6)28)21(33-16(5)27)20(32-15(4)26)19(35-23)12-30-13(2)24/h1,18-23H,10-12H2,2-6H3/t18?,19-,20-,21+,22-,23-/m0/s1
InChIKey JLCGNCQVVIUWFN-RWCPEOFKSA-N
Literature Reference Author J.JAKUPOVIC,R.X.TAN,F.BOHLMANN,Z.J.JIA,S.HUNECK
Literature Reference Citation PLANTA.MED.,57,450(1991)
Literature Reference DOI 10.1055/s-2006-960148
Molecular Weight 496.468 g/mol
Solvent CDCl3
Source File Reference UIAP191