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ITOSIDE_M;1-BETA,6-BETA-DIHYDROXY-2-ENOIC_CYCLOHEX-1-O-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID AfBvpJj5vxr
InChI InChI=1S/C12H20O7/c13-5-8-9(15)10(16)11(17)12(19-8)18-7-4-2-1-3-6(7)14/h2,4,6-17H,1,3,5H2/t6-,7+,8-,9-,10+,11-,12-/m0/s1
InChIKey AEDRDGQOEJEODM-MQOZHFKUSA-N
Mol Weight 276.28 g/mol
Molecular Formula C12H20O7
Exact Mass 276.120903 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HcXUdoI44Vx
Name ITOSIDE_M;1-BETA,6-BETA-DIHYDROXY-2-ENOIC_CYCLOHEX-1-O-BETA-D-GLUCOPYRANOSIDE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H20O7
InChI InChI=1S/C12H20O7/c13-5-8-9(15)10(16)11(17)12(19-8)18-7-4-2-1-3-6(7)14/h2,4,6-17H,1,3,5H2/t6-,7+,8-,9-,10+,11-,12-/m0/s1
InChIKey AEDRDGQOEJEODM-MQOZHFKUSA-N
Literature Reference Author X.Y.CHAI,Y.L.SONG,Z.R.XU,H.M.SHI,C.C.BAI,D.BI,J.WEN,F.F.LI,P .F.TU
Literature Reference Citation J.NAT.PROD.,71,814(2008)
Literature Reference DOI 10.1021/np800014s
Molecular Weight 276.287 g/mol
Sample ID 28266
Solvent CD3OD