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#18;TERT.-BUTYLDIMETHYLSILYL-METHYL-[METHYL-(2-O-ACETYL-4-O-ALLYL-3-O-BENZYL-ALPHA-L-IDOPYRANOSID)-URONATE-(1->4)-2-ACETAMIDO-3,6-DI-O-BENZYL-2-DEOXY-ALPHA-D-G
SpectraBase Compound ID 120QfzryCMa
InChI InChI=1S/C61H79NO19Si/c1-11-32-71-50-51(74-36-43-30-22-15-23-31-43)55(75-39(3)64)60(80-53(50)56(66)68-7)77-47-44(37-70-33-40-24-16-12-17-25-40)76-58(45(62-38(2)63)48(47)72-34-41-26-18-13-19-27-41)78-52-49(73-35-42-28-20-14-21-29-42)46(65)59(79-54(52)57(67)69-8)81-82(9,10)61(4,5)6/h11-31,44-55,58-60,65H,1,32-37H2,2-10H3,(H,62,63)/t44-,45-,46-,47-,48-,49-,50+,51+,52+,53-,54-,55-,58-,59-,60-/m1/s1
InChIKey YOHRCPLVJZATDL-LRNRWSIDSA-N
Mol Weight 1158.4 g/mol
Molecular Formula C61H79NO19Si
Exact Mass 1157.501556 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JL0ao3LDUgQ
Name #18;TERT.-BUTYLDIMETHYLSILYL-METHYL-[METHYL-(2-O-ACETYL-4-O-ALLYL-3-O-BENZYL-ALPHA-L-IDOPYRANOSID)-URONATE-(1->4)-2-ACETAMIDO-3,6-DI-O-BENZYL-2-DEOXY-ALPHA-D-G
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C61H79NO19Si
InChI InChI=1S/C61H79NO19Si/c1-11-32-71-50-51(74-36-43-30-22-15-23-31-43)55(75-39(3)64)60(80-53(50)56(66)68-7)77-47-44(37-70-33-40-24-16-12-17-25-40)76-58(45(62-38(2)63)48(47)72-34-41-26-18-13-19-27-41)78-52-49(73-35-42-28-20-14-21-29-42)46(65)59(79-54(52)57(67)69-8)81-82(9,10)61(4,5)6/h11-31,44-55,58-60,65H,1,32-37H2,2-10H3,(H,62,63)/t44-,45-,46-,47-,48-,49-,50+,51+,52+,53-,54-,55-,58-,59-,60-/m1/s1
InChIKey YOHRCPLVJZATDL-LRNRWSIDSA-N
Literature Reference Author G.J.S.LOHMAN,P.H.SEEBERGER
Literature Reference Citation J.ORG.CHEM.,69,4081(2004)
Literature Reference DOI 10.1021/jo035732z
Molecular Weight 1158.379 g/mol
Solvent CDCl3
Source File Reference UWVN21643