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#4;DECOSANYL-TRIGLUCOSIDE;N-DOCOSANYL-BETA-D-GLUCOPYRANOSYL-(2'->1'')-BETA-D-GLUCOPYRANOSYL-(2''->1''')-BETA-D-(2''',3''',4'''-TRIACETYL)-GLUCOPYRANOSIDE
SpectraBase Compound ID 948xyBvM17g
InChI InChI=1S/C46H82O19/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-57-44-40(37(55)35(53)32(26-47)61-44)64-45-41(38(56)36(54)33(27-48)62-45)65-46-43(60-31(4)52)42(59-30(3)51)39(58-29(2)50)34(28-49)63-46/h32-49,53-56H,5-28H2,1-4H3/t32-,33+,34+,35+,36-,37+,38-,39-,40-,41+,42-,43+,44-,45-,46-/m0/s1
InChIKey NVLQVHZTAMFTTA-YEYNBSIXSA-N
Mol Weight 939.1 g/mol
Molecular Formula C46H82O19
Exact Mass 938.54503 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A5xbt5XrgBS
Name #4;DECOSANYL-TRIGLUCOSIDE;N-DOCOSANYL-BETA-D-GLUCOPYRANOSYL-(2'->1'')-BETA-D-GLUCOPYRANOSYL-(2''->1''')-BETA-D-(2''',3''',4'''-TRIACETYL)-GLUCOPYRANOSIDE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C46H82O19
InChI InChI=1S/C46H82O19/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-57-44-40(37(55)35(53)32(26-47)61-44)64-45-41(38(56)36(54)33(27-48)62-45)65-46-43(60-31(4)52)42(59-30(3)51)39(58-29(2)50)34(28-49)63-46/h32-49,53-56H,5-28H2,1-4H3/t32-,33+,34+,35+,36-,37+,38-,39-,40-,41+,42-,43+,44-,45-,46-/m0/s1
InChIKey NVLQVHZTAMFTTA-YEYNBSIXSA-N
Literature Reference Author M.SHUAIB,M.ALI,K.J.NAQUVI
Literature Reference Citation J.CHEM.PHARM.RES.,5,8,42(2013)
Molecular Weight 939.146 g/mol
Solvent CDCl3
Source File Reference UWBT13696