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#69;DIBENZYL-[METHYL-O-(METHYL-5-ACETAMIDO-4,7,8,9-TETRA-O-ACETYL-3,5-DIDEOXY-D-GLYCERO-ALPHA-D-GALACTO-2-NONULOPYRANOSYLONATE)-(2->9)-5-ACETAMIDO-4,7,8-TRI-O-
SpectraBase Compound ID 7k8sNff7uUz
InChI InChI=1S/C52H67N2O26P/c1-28(55)53-43-39(72-31(4)58)22-51(49(64)66-10,78-47(43)45(76-35(8)62)41(74-33(6)60)26-68-30(3)57)69-27-42(75-34(7)61)46(77-36(9)63)48-44(54-29(2)56)40(73-32(5)59)23-52(79-48,50(65)67-11)80-81(70-24-37-18-14-12-15-19-37)71-25-38-20-16-13-17-21-38/h12-21,39-48H,22-27H2,1-11H3,(H,53,55)(H,54,56)/t39-,40+,41+,42+,43+,44-,45-,46+,47+,48-,51+,52-/m1/s1
InChIKey SMCWXRSQOCNRGY-FHRPJFBYSA-N
Mol Weight 1167.1 g/mol
Molecular Formula C52H67N2O26P
Exact Mass 1166.371967 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GcSXTB6n7Jg
Name #69;DIBENZYL-[METHYL-O-(METHYL-5-ACETAMIDO-4,7,8,9-TETRA-O-ACETYL-3,5-DIDEOXY-D-GLYCERO-ALPHA-D-GALACTO-2-NONULOPYRANOSYLONATE)-(2->9)-5-ACETAMIDO-4,7,8-TRI-O-
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C52H67N2O26P
InChI InChI=1S/C52H67N2O26P/c1-28(55)53-43-39(72-31(4)58)22-51(49(64)66-10,78-47(43)45(76-35(8)62)41(74-33(6)60)26-68-30(3)57)69-27-42(75-34(7)61)46(77-36(9)63)48-44(54-29(2)56)40(73-32(5)59)23-52(79-48,50(65)67-11)80-81(70-24-37-18-14-12-15-19-37)71-25-38-20-16-13-17-21-38/h12-21,39-48H,22-27H2,1-11H3,(H,53,55)(H,54,56)/t39-,40+,41+,42+,43+,44-,45-,46+,47+,48-,51+,52-/m1/s1
InChIKey SMCWXRSQOCNRGY-FHRPJFBYSA-N
Literature Reference Author M.IZUMI,G.J.SHEN,S.WACOWICH-SGARBI,T.NAKATANI,O.PLETTENBURG, C.H.WONG
Literature Reference Citation J.AM.CHEM.SOC.,123,10909(2001)
Literature Reference DOI 10.1021/ja011382r
Solvent CDCl3
Source File Reference UWLU30812