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12-BROMODODECYL-TETRA-O-BENZOYL-BETA-D-GLUCOPYRANOSIDE

View entire compound with spectra: 1 NMR

12-BROMODODECYL-TETRA-O-BENZOYL-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID GAipn8SggOh
InChI InChI=1S/C46H51BrO10/c47-31-21-7-5-3-1-2-4-6-8-22-32-52-46-41(57-45(51)37-29-19-12-20-30-37)40(56-44(50)36-27-17-11-18-28-36)39(55-43(49)35-25-15-10-16-26-35)38(54-46)33-53-42(48)34-23-13-9-14-24-34/h9-20,23-30,38-41,46H,1-8,21-22,31-33H2/t38-,39-,40+,41-,46-/m0/s1
InChIKey QUNXFJARLBCYNJ-VSBXHWRZSA-N
Mol Weight 843.8 g/mol
Molecular Formula C46H51BrO10
Exact Mass 842.266561 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CxWlBJ1PRCs
Name 12-BROMODODECYL-TETRA-O-BENZOYL-BETA-D-GLUCOPYRANOSIDE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C46H51BrO10
InChI InChI=1S/C46H51BrO10/c47-31-21-7-5-3-1-2-4-6-8-22-32-52-46-41(57-45(51)37-29-19-12-20-30-37)40(56-44(50)36-27-17-11-18-28-36)39(55-43(49)35-25-15-10-16-26-35)38(54-46)33-53-42(48)34-23-13-9-14-24-34/h9-20,23-30,38-41,46H,1-8,21-22,31-33H2/t38-,39-,40+,41-,46-/m0/s1
InChIKey QUNXFJARLBCYNJ-VSBXHWRZSA-N
Literature Reference Author J.REINHARD,W.E.HULL,C.W.V.D.LIETH,U.EICHHORN,H.C.KLIEM,B.KAI NA,M.WIESSLER
Literature Reference Citation J.MED.CHEM.,44,4050(2001)
Literature Reference DOI 10.1021/jm010006e
Molecular Weight 843.809 g/mol
Sample ID 45154
Solvent CDCl3