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SILYBIN-7-O-BETA-D-GLUCURONOPYRANOSIDE

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SILYBIN-7-O-BETA-D-GLUCURONOPYRANOSIDE
SpectraBase Compound ID GXslwJMMiY3
InChI InChI=1S/C31H30O16/c1-42-17-6-11(2-4-14(17)33)27-20(10-32)44-16-5-3-12(7-18(16)45-27)28-24(37)22(35)21-15(34)8-13(9-19(21)46-28)43-31-26(39)23(36)25(38)29(47-31)30(40)41/h2-9,20,23-29,31-34,36-39H,10H2,1H3,(H,40,41)/t20?,23-,24+,25-,26+,27?,28-,29-,31+/m1/s1
InChIKey CEEVTPGDIZSRFF-CVVLSEGGSA-N
Mol Weight 658.57 g/mol
Molecular Formula C31H30O16
Exact Mass 658.153385 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DDPUnKDC50u
Name SILYBIN_A-7-O-BETA-GLUCURONIDE;M1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H30O16
InChI InChI=1S/C31H30O16/c1-42-17-6-11(2-4-14(17)33)27-20(10-32)44-16-5-3-12(7-18(16)45-27)28-24(37)22(35)21-15(34)8-13(9-19(21)46-28)43-31-26(39)23(36)25(38)29(47-31)30(40)41/h2-9,20,23-29,31-34,36-39H,10H2,1H3,(H,40,41)/t20?,23-,24+,25-,26+,27?,28-,29-,31+/m1/s1
InChIKey CEEVTPGDIZSRFF-CVVLSEGGSA-N
Literature Reference Author Y.H.HAN,H.X.LOU,D.M.REN,L.R.SUN,B.MA,M.JI
Literature Reference Citation J.PHARM.BIOM.ANAL.,34,1071(2004)
Literature Reference DOI 10.1016/j.jpba.2003.12.002
Molecular Weight 658.570 g/mol
Solvent DMSO-D6
Source File Reference UWMZ45011