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#16;2-TRIMETHYLETHYLSILYL-(BENZYL-5-ACETAMIDO-4,7,8,9-TETRA-O-ACETYL-3,5-DIDEOXY-D-GLYCERO-ALPHA-D-GALACTO-2-NONULOPYRANOSIDONATE)-(2->3)-(2,4-DI-O-ACET
SpectraBase Compound ID KVhDjFGMctO
InChI InChI=1S/C63H82N2O26Si/c1-35(66)64-50-46(82-38(4)69)29-63(62(76)81-31-44-23-17-13-18-24-44,90-56(50)54(84-40(6)71)48(83-39(5)70)33-79-37(3)68)91-57-55(85-41(7)72)49(34-80-59(75)45-25-19-14-20-26-45)88-61(58(57)86-42(8)73)89-53-47(32-77-30-43-21-15-12-16-22-43)87-60(78-27-28-92(9,10)11)51(52(53)74)65-36(2)67/h12-26,46-58,60-61,74H,27-34H2,1-11H3,(H,64,66)(H,65,67)/t46-,47-,48-,49-,50+,51-,52-,53-,54-,55+,56+,57+,58-,60-,61-,63-/m0/s1
InChIKey XWJZHRHSQBTMNI-UHTWDOCJSA-N
Mol Weight 1311.4 g/mol
Molecular Formula C63H82N2O26Si
Exact Mass 1310.492507 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6Kcymo6aiGY
Name #16;2-TRIMETHYLETHYLSILYL-(BENZYL-5-ACETAMIDO-4,7,8,9-TETRA-O-ACETYL-3,5-DIDEOXY-D-GLYCERO-ALPHA-D-GALACTO-2-NONULOPYRANOSIDONATE)-(2->3)-(2,4-DI-O-ACET
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C63H82N2O26Si
InChI InChI=1S/C63H82N2O26Si/c1-35(66)64-50-46(82-38(4)69)29-63(62(76)81-31-44-23-17-13-18-24-44,90-56(50)54(84-40(6)71)48(83-39(5)70)33-79-37(3)68)91-57-55(85-41(7)72)49(34-80-59(75)45-25-19-14-20-26-45)88-61(58(57)86-42(8)73)89-53-47(32-77-30-43-21-15-12-16-22-43)87-60(78-27-28-92(9,10)11)51(52(53)74)65-36(2)67/h12-26,46-58,60-61,74H,27-34H2,1-11H3,(H,64,66)(H,65,67)/t46-,47-,48-,49-,50+,51-,52-,53-,54-,55+,56+,57+,58-,60-,61-,63-/m0/s1
InChIKey XWJZHRHSQBTMNI-UHTWDOCJSA-N
Literature Reference Author A.TITZ,A.MARRA,B.CUTTING,M.SMIESKO,G.PAPANDREOU,A.DONDONI,B. ERNST
Literature Reference Citation EUR.J.ORG.CHEM.,2012,5534(2012)
Literature Reference DOI 10.1002/ejoc.201200744
Molecular Weight 1311.427 g/mol
Solvent CD2Cl2
Source File Reference UWLU84021