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28-O-BETA-D-GLUCOPYRANOSYL-QUINOVIC-ACID
SpectraBase Compound ID E1UxQY4fc56
InChI InChI=1S/C36H56O10/c1-18-9-14-35(31(44)46-29-28(41)27(40)26(39)21(17-37)45-29)15-16-36(30(42)43)20(25(35)19(18)2)7-8-23-33(5)12-11-24(38)32(3,4)22(33)10-13-34(23,36)6/h7,18-19,21-29,37-41H,8-17H2,1-6H3,(H,42,43)/t18-,19+,21-,22+,23-,24+,25+,26-,27+,28-,29+,33+,34-,35+,36-/m1/s1
InChIKey CLZXUPFAWZANJB-ZZZTYRQWSA-N
Mol Weight 648.8 g/mol
Molecular Formula C36H56O10
Exact Mass 648.387348 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HR3cYsgMAIP
Name 28-O-BETA-D-GLUCOPYRANOSYL-QUINOVIC-ACID
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H56O10
InChI InChI=1S/C36H56O10/c1-18-9-14-35(31(44)46-29-28(41)27(40)26(39)21(17-37)45-29)15-16-36(30(42)43)20(25(35)19(18)2)7-8-23-33(5)12-11-24(38)32(3,4)22(33)10-13-34(23,36)6/h7,18-19,21-29,37-41H,8-17H2,1-6H3,(H,42,43)/t18-,19+,21-,22+,23-,24+,25+,26-,27+,28-,29+,33+,34-,35+,36-/m1/s1
InChIKey CLZXUPFAWZANJB-ZZZTYRQWSA-N
Literature Reference Author L.HAMERSKI,C.A.CARBONEZI,A.J.CAVALHEIRO,V.D.S.BOLZANI,M.C.M. YOUNG
Literature Reference Citation QUIM.NOVA,28,601(2005)
Literature Reference DOI 10.1590/s0100-40422005000400009
Molecular Weight 648.835 g/mol
Solvent DMSO-D6
Source File Reference UWBT12214