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(3R,4S,5R,6S)-3-ACETOXY-5,6-DIBENZYLOXY-3-BENZYLOXYMETHYL-4-(2,3-DI-O-BENZYL-4,6-O-BENZYLIDENE-BETA-D-GLUCOPYRANOSYLOXY)-CYCLOHEXENE

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(3R,4S,5R,6S)-3-ACETOXY-5,6-DIBENZYLOXY-3-BENZYLOXYMETHYL-4-(2,3-DI-O-BENZYL-4,6-O-BENZYLIDENE-BETA-D-GLUCOPYRANOSYLOXY)-CYCLOHEXENE
SpectraBase Compound ID 4klAJ8PDcaa
InChI InChI=1S/C57H58O11/c1-41(58)68-57(40-59-34-42-20-8-2-9-21-42)33-32-48(60-35-43-22-10-3-11-23-43)51(61-36-44-24-12-4-13-25-44)54(57)67-56-53(63-38-46-28-16-6-17-29-46)52(62-37-45-26-14-5-15-27-45)50-49(65-56)39-64-55(66-50)47-30-18-7-19-31-47/h2-33,48-56H,34-40H2,1H3/t48-,49-,50-,51+,52+,53-,54-,55-,56+,57+/m0/s1
InChIKey LHEABHXFAMNAKD-OERJUAMGSA-N
Mol Weight 919.1 g/mol
Molecular Formula C57H58O11
Exact Mass 918.397913 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LwIEjczV50w
Name (3R,4S,5R,6S)-3-ACETOXY-5,6-DIBENZYLOXY-3-BENZYLOXYMETHYL-4-(2,3-DI-O-BENZYL-4,6-O-BENZYLIDENE-BETA-D-GLUCOPYRANOSYLOXY)-CYCLOHEXENE
Compound Number 15
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C57H58O11
InChI InChI=1S/C57H58O11/c1-41(58)68-57(40-59-34-42-20-8-2-9-21-42)33-32-48(60-35-43-22-10-3-11-23-43)51(61-36-44-24-12-4-13-25-44)54(57)67-56-53(63-38-46-28-16-6-17-29-46)52(62-37-45-26-14-5-15-27-45)50-49(65-56)39-64-55(66-50)47-30-18-7-19-31-47/h2-33,48-56H,34-40H2,1H3/t48-,49-,50-,51+,52+,53-,54-,55-,56+,57+/m0/s1
InChIKey LHEABHXFAMNAKD-OERJUAMGSA-N
Literature Reference Author J.K.FAIRWEATHER,M.J.MCDONOUGH,R.V.STICK,D.M.G.TILBROOK
Literature Reference Citation AUSTR.J.CHEM.,57,197(2004)
Literature Reference DOI 10.1071/CH03203
Molecular Weight 919.081 g/mol
Solvent Unknown
Source File Reference UWVN7463