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METHYL-2,3-DI-O-BENZYL-6-O-CINNAMYL-4-[3-(IODOACETAMIDE)-BENZAMIDE]-4-DEOXY-ALPHA-D-GALACTOPYRANOSIDE
SpectraBase Compound ID 1Mr7s89qvbo
InChI InChI=1S/C39H41IN2O7/c1-45-39-37(48-26-30-17-9-4-10-18-30)36(47-25-29-15-7-3-8-16-29)35(33(49-39)27-46-22-12-19-28-13-5-2-6-14-28)42-38(44)31-20-11-21-32(23-31)41-34(43)24-40/h2-21,23,33,35-37,39H,22,24-27H2,1H3,(H,41,43)(H,42,44)/b19-12+/t33-,35+,36+,37-,39+/m0/s1
InChIKey AIZZNNRQVPEGHF-GWINIPAXSA-N
Mol Weight 776.7 g/mol
Molecular Formula C39H41IN2O7
Exact Mass 776.195847 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9EkmK9omTSo
Name METHYL-2,3-DI-O-BENZYL-6-O-CINNAMYL-4-[3-(IODOACETAMIDE)-BENZAMIDE]-4-DEOXY-ALPHA-D-GALACTOPYRANOSIDE
Compound Number 20
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C39H41IN2O7
InChI InChI=1S/C39H41IN2O7/c1-45-39-37(48-26-30-17-9-4-10-18-30)36(47-25-29-15-7-3-8-16-29)35(33(49-39)27-46-22-12-19-28-13-5-2-6-14-28)42-38(44)31-20-11-21-32(23-31)41-34(43)24-40/h2-21,23,33,35-37,39H,22,24-27H2,1H3,(H,41,43)(H,42,44)/b19-12+/t33-,35+,36+,37-,39+/m0/s1
InChIKey AIZZNNRQVPEGHF-GWINIPAXSA-N
Literature Reference Author D.H.S.LEAL,C.G.QUEIROGA,M.C.PIRES,M.A.F.PRADO,R.J.ALVES,A.CE SAR
Literature Reference Citation QUIM.NOVA,32,2387(2009)
Molecular Weight 776.668 g/mol
Solvent CDCl3
Source File Reference UWBT12032