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5-METHYL-3-[1',2',3',4',5'-PENTA-O-BENZOYL-D-MANNO-PENTITOL-1'-YL]-1,2,4-OXADIAZOLE

View entire compound with spectra: 1 NMR

5-METHYL-3-[1',2',3',4',5'-PENTA-O-BENZOYL-D-MANNO-PENTITOL-1'-YL]-1,2,4-OXADIAZOLE
SpectraBase Compound ID 6V2GhMUKIFt
InChI InChI=1S/C43H34N2O11/c1-28-44-38(45-56-28)37(55-43(50)33-25-15-6-16-26-33)36(54-42(49)32-23-13-5-14-24-32)35(53-41(48)31-21-11-4-12-22-31)34(52-40(47)30-19-9-3-10-20-30)27-51-39(46)29-17-7-2-8-18-29/h2-26,34-37H,27H2,1H3/t34-,35+,36-,37+/m1/s1
InChIKey ZGMAKGLQXPDNLC-VQJPNMBPSA-N
Mol Weight 754.7 g/mol
Molecular Formula C43H34N2O11
Exact Mass 754.21626 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID qL331SynxA
Name 5-METHYL-3-[1',2',3',4',5'-PENTA-O-BENZOYL-D-MANNO-PENTITOL-1'-YL]-1,2,4-OXADIAZOLE
Compound Number 6
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C43H34N2O11/c1-28-44-38(45-56-28)37(55-43(50)33-25-15-6-16-26-33)36(54-42(49)32-23-13-5-14-24-32)35(53-41(48)31-21-11-4-12-22-31)34(52-40(47)30-19-9-3-10-20-30)27-51-39(46)29-17-7-2-8-18-29/h2-26,34-37H,27H2,1H3/t34-,35+,36-,37+/m1/s1
InChIKey ZGMAKGLQXPDNLC-VQJPNMBPSA-N
Literature Reference M.L.FASCIO,N.B.DACCORSO J.HETCYCL.CHEM.,32,815(1995)
Solvent Chloroform-d