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METHYL-2,3,6-TRI-O-BENZOYL-4-DEOXY-[(1'R,4'R,5'S,6'S)-4',5',6'-TRIBENZYLOXY-3'-(BENZYLOXYMETHYL)-CYCLOHEX-2'-ENYL]-AMINO-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID A70nFgdKznc
InChI InChI=1S/C63H61NO12/c1-68-63-59(76-62(67)50-35-21-8-22-36-50)57(75-61(66)49-33-19-7-20-34-49)54(53(74-63)43-73-60(65)48-31-17-6-18-32-48)64-52-37-51(42-69-38-44-23-9-2-10-24-44)55(70-39-45-25-11-3-12-26-45)58(72-41-47-29-15-5-16-30-47)56(52)71-40-46-27-13-4-14-28-46/h2-37,52-59,63-64H,38-43H2,1H3/t52-,53+,54+,55-,56+,57-,58+,59+,63+/m1/s1
InChIKey WGPIUACIQVIXNV-NAMSXDRNSA-N
Mol Weight 1024.2 g/mol
Molecular Formula C63H61NO12
Exact Mass 1023.419376 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GamsVoKYG7A
Name METHYL-2,3,6-TRI-O-BENZOYL-4-DEOXY-[(1'R,4'R,5'S,6'S)-4',5',6'-TRIBENZYLOXY-3'-(BENZYLOXYMETHYL)-CYCLOHEX-2'-ENYL]-AMINO-BETA-D-GLUCOPYRANOSIDE
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C63H61NO12
InChI InChI=1S/C63H61NO12/c1-68-63-59(76-62(67)50-35-21-8-22-36-50)57(75-61(66)49-33-19-7-20-34-49)54(53(74-63)43-73-60(65)48-31-17-6-18-32-48)64-52-37-51(42-69-38-44-23-9-2-10-24-44)55(70-39-45-25-11-3-12-26-45)58(72-41-47-29-15-5-16-30-47)56(52)71-40-46-27-13-4-14-28-46/h2-37,52-59,63-64H,38-43H2,1H3/t52-,53+,54+,55-,56+,57-,58+,59+,63+/m1/s1
InChIKey WGPIUACIQVIXNV-NAMSXDRNSA-N
Literature Reference Author M.J.MCDONOUGH,R.V.STICK,D.M.G.TILBROOK,A.G.WATTS
Literature Reference Citation AUSTR.J.CHEM.,57,233(2004)
Literature Reference DOI 10.1071/CH03185
Molecular Weight 1024.177 g/mol
Solvent Unknown
Source File Reference UWVN7493