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BICYCLO(2-O-ACETYL-3,5-DI-O-BENZOYL-BETA-D-GALACTOFURANOSYL[1->6])
SpectraBase Compound ID AR3vAsDoNJ4
InChI InChI=1S/C44H40O16/c1-25(45)53-37-35(57-41(49)29-19-11-5-12-20-29)33-31(55-39(47)27-15-7-3-8-16-27)24-52-44-38(54-26(2)46)36(58-42(50)30-21-13-6-14-22-30)34(60-44)32(23-51-43(37)59-33)56-40(48)28-17-9-4-10-18-28/h3-22,31-38,43-44H,23-24H2,1-2H3/t31-,32?,33-,34-,35-,36-,37+,38+,43+,44+/m0/s1
InChIKey AQRVMGMILWRNCP-SVTHEZQRSA-N
Mol Weight 824.8 g/mol
Molecular Formula C44H40O16
Exact Mass 824.231635 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EITp57deHFA
Name BICYCLO(2-O-ACETYL-3,5-DI-O-BENZOYL-BETA-D-GALACTOFURANOSYL[1->6])
Comments 16
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C44H40O16
InChI InChI=1S/C44H40O16/c1-25(45)53-37-35(57-41(49)29-19-11-5-12-20-29)33-31(55-39(47)27-15-7-3-8-16-27)24-52-44-38(54-26(2)46)36(58-42(50)30-21-13-6-14-22-30)34(60-44)32(23-51-43(37)59-33)56-40(48)28-17-9-4-10-18-28/h3-22,31-38,43-44H,23-24H2,1-2H3/t31-,32?,33-,34-,35-,36-,37+,38+,43+,44+/m0/s1
InChIKey AQRVMGMILWRNCP-SVTHEZQRSA-N
Instrument Name Bruker AM-300
Literature Reference L.V.BAKINOVSKY, S.A.NEPOGOD'EV, N.K.KOCHETKOV (1988) Bioorganich.Khim.(Russ.Lang.): v.14, N8, 1122-1124.
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported