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METHYL-(METHYL-2,3,4-TRI-O-BENZOYL-ALPHA-D-GLUCOPYRANOSIDE)-URONATE
SpectraBase Compound ID 1HSVmaCU0s7
InChI InChI=1S/C29H26O10/c1-34-28(33)23-21(36-25(30)18-12-6-3-7-13-18)22(37-26(31)19-14-8-4-9-15-19)24(29(35-2)39-23)38-27(32)20-16-10-5-11-17-20/h3-17,21-24,29H,1-2H3/t21-,22-,23-,24+,29-/m1/s1
InChIKey FOYBQRCGSBNKNQ-QLZABZSJSA-N
Mol Weight 534.52 g/mol
Molecular Formula C29H26O10
Exact Mass 534.152597 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C8XnujhXCel
Name METHYL-(METHYL-2,3,4-TRI-O-BENZOYL-ALPHA-D-GLUCOPYRANOSIDE)-URONATE
Compound Number 4A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H26O10
InChI InChI=1S/C29H26O10/c1-34-28(33)23-21(36-25(30)18-12-6-3-7-13-18)22(37-26(31)19-14-8-4-9-15-19)24(29(35-2)39-23)38-27(32)20-16-10-5-11-17-20/h3-17,21-24,29H,1-2H3/t21-,22-,23-,24+,29-/m1/s1
InChIKey FOYBQRCGSBNKNQ-QLZABZSJSA-N
Literature Reference Author A.M.ESMURZIEV,A.REIMERS,T.ANDREASSEN,N.SIMIC,E.SUNDBY,B.H.HO FF
Literature Reference Citation MOLECULES,17,820(2012)
Literature Reference DOI 10.3390/molecules17010820
Molecular Weight 534.519 g/mol
Sample ID 73011
Solvent CDCl3