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O-(2,3,5,6-TETRA-O-BENZOYL-BETA-D-GALACTOFURANOSYL)-(1->6)-O-(2,3,5-TRI-O-BENZOYL-BETA-D-GALACTOFURANOSYL)-(1->6)-3,5-DI-O-BENZOYL-1,2-O-[1-(EXO-CYANO)ETHYLIDENE]-ALPHA-D-GALACTOFURANOSE
SpectraBase Compound ID FjPdrLxEzUW
InChI InChI=1S/C84H69NO25/c1-84(50-85)109-71-68(103-78(92)57-41-23-8-24-42-57)65(108-83(71)110-84)62(100-75(89)54-35-17-5-18-36-54)49-97-82-70(105-80(94)59-45-27-10-28-46-59)67(102-77(91)56-39-21-7-22-40-56)64(107-82)61(99-74(88)53-33-15-4-16-34-53)48-96-81-69(104-79(93)58-43-25-9-26-44-58)66(101-76(90)55-37-19-6-20-38-55)63(106-81)60(98-73(87)52-31-13-3-14-32-52)47-95-72(86)51-29-11-2-12-30-51/h2-46,60-71,81-83H,47-49H2,1H3/t60-,61-,62-,63-,64-,65-,66-,67-,68-,69+,70+,71+,81+,82+,83+,84+/m0/s1
InChIKey RSIMYIRGDSLSGC-QXURUFLESA-N
Mol Weight 1492.5 g/mol
Molecular Formula C84H69NO25
Exact Mass 1491.415867 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Al9N9RIwrNF
Name O-(2,3,5,6-TETRA-O-BENZOYL-BETA-D-GALACTOFURANOSYL)-(1->6)-O-(2,3,5-TRI-O-BENZOYL-BETA-D-GALACTOFURANOSYL)-(1->6)-3,5-DI-O-BENZOYL-1,2-O-[1-(EXO-CYANO)ETHYLIDENE]-ALPHA-D-GALACTOFURANOSE
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Formula C84H69NO25
InChI InChI=1S/C84H69NO25/c1-84(50-85)109-71-68(103-78(92)57-41-23-8-24-42-57)65(108-83(71)110-84)62(100-75(89)54-35-17-5-18-36-54)49-97-82-70(105-80(94)59-45-27-10-28-46-59)67(102-77(91)56-39-21-7-22-40-56)64(107-82)61(99-74(88)53-33-15-4-16-34-53)48-96-81-69(104-79(93)58-43-25-9-26-44-58)66(101-76(90)55-37-19-6-20-38-55)63(106-81)60(98-73(87)52-31-13-3-14-32-52)47-95-72(86)51-29-11-2-12-30-51/h2-46,60-71,81-83H,47-49H2,1H3/t60-,61-,62-,63-,64-,65-,66-,67-,68-,69+,70+,71+,81+,82+,83+,84+/m0/s1
InChIKey RSIMYIRGDSLSGC-QXURUFLESA-N
Instrument Name Bruker WM-250
Literature Reference S.A.NEPOGOD'EV, L.V.BAKINOVSKY, N.K.KOCHETKOV (1990) Bioorganich.Khim.(Russ.Lang.): v.16, N2, 236-249.
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3