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2R,3R;(2R,3R)-1-(4-ACETOXY-3-METHOXYPHENYL)-1-O-(1-O-METHYL,2-DEOXY-3,4-DI-O-ACETYL-BETA-D-XYLOPYRANOS-2-YL)-2-METHOXYPHENOXY)-3-O-METHY
SpectraBase Compound ID 5oBOMYXa5Hm
InChI InChI=1S/C31H38O14/c1-17(32)39-15-26(44-23-11-9-8-10-22(23)36-5)28(21-12-13-24(41-18(2)33)25(14-21)37-6)45-30-29(43-20(4)35)27(42-19(3)34)16-40-31(30)38-7/h8-14,26-31H,15-16H2,1-7H3/t26-,27-,28-,29+,30-,31-/m0/s1
InChIKey SEJLGFJPNHXHQN-MACKVBDYSA-N
Mol Weight 634.6 g/mol
Molecular Formula C31H38O14
Exact Mass 634.226156 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CRdhB3QBnHX
Name 2R,3R;(2R,3R)-1-(4-ACETOXY-3-METHOXYPHENYL)-1-O-(1-O-METHYL,2-DEOXY-3,4-DI-O-ACETYL-BETA-D-XYLOPYRANOS-2-YL)-2-METHOXYPHENOXY)-3-O-METHY
Compound Number 5,T-2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H38O14
InChI InChI=1S/C31H38O14/c1-17(32)39-15-26(44-23-11-9-8-10-22(23)36-5)28(21-12-13-24(41-18(2)33)25(14-21)37-6)45-30-29(43-20(4)35)27(42-19(3)34)16-40-31(30)38-7/h8-14,26-31H,15-16H2,1-7H3/t26-,27-,28-,29+,30-,31-/m0/s1
InChIKey SEJLGFJPNHXHQN-MACKVBDYSA-N
Literature Reference Author M.TOIKKA,G.BRUNOW
Literature Reference Citation J.CHEM.SOC.PERKIN-1,1877(1999)
Literature Reference DOI 10.1039/a900434c
Molecular Weight 634.634 g/mol
Solvent ACETONE-D6
Source File Reference UWRU5624