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EMODIN-8-BETA-D-(6'-O-ACETYL)-GLUCOPYRANOSIDE

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EMODIN-8-BETA-D-(6'-O-ACETYL)-GLUCOPYRANOSIDE
SpectraBase Compound ID LMO8hyhJRYl
InChI InChI=1S/C23H22O11/c1-8-3-11-16(13(26)4-8)20(29)17-12(18(11)27)5-10(25)6-14(17)33-23-22(31)21(30)19(28)15(34-23)7-32-9(2)24/h3-6,15,19,21-23,25-26,28,30-31H,7H2,1-2H3/t15-,19-,21+,22-,23-/m1/s1
InChIKey RTJITOQQRDULKR-UGPBBDQXSA-N
Mol Weight 474.42 g/mol
Molecular Formula C23H22O11
Exact Mass 474.116212 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F5JOtKzyezS
Name EMODIN-8-BETA-D-(6'-O-ACETYL)-GLUCOPYRANOSIDE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H22O11
InChI InChI=1S/C23H22O11/c1-8-3-11-16(13(26)4-8)20(29)17-12(18(11)27)5-10(25)6-14(17)33-23-22(31)21(30)19(28)15(34-23)7-32-9(2)24/h3-6,15,19,21-23,25-26,28,30-31H,7H2,1-2H3/t15-,19-,21+,22-,23-/m1/s1
InChIKey RTJITOQQRDULKR-UGPBBDQXSA-N
Literature Reference Author H.Y.QI,C.F.ZHANG,M.ZHANG,J.Q.LIU,Z.T.WANG
Literature Reference Citation CHIN.CHEM.LETT.,16,1050(2005)
Molecular Weight 474.421 g/mol
Sample ID 35837
Solvent DMSO-D6