For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
6-[O(6)-(4-BROMOTHENYL)-GUAN-9-YL]-HEXYL-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID 9ErcPr7tDX6
InChI InChI=1S/C22H30BrN5O7S/c23-12-7-13(36-10-12)9-34-20-15-19(26-22(24)27-20)28(11-25-15)5-3-1-2-4-6-33-21-18(32)17(31)16(30)14(8-29)35-21/h7,10-11,14,16-18,21,29-32H,1-6,8-9H2,(H2,24,26,27)/t14-,16-,17+,18-,21-/m1/s1
InChIKey ZMMBMLJGFSVJRG-YUZRNDJPSA-N
Mol Weight 588.47 g/mol
Molecular Formula C22H30BrN5O7S
Exact Mass 587.104932 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID K3NdWXXFkKG
Name 6-[O(6)-(4-BROMOTHENYL)-GUAN-9-YL]-HEXYL-BETA-D-GLUCOPYRANOSIDE
Compound Number 18
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H30BrN5O7S
InChI InChI=1S/C22H30BrN5O7S/c23-12-7-13(36-10-12)9-34-20-15-19(26-22(24)27-20)28(11-25-15)5-3-1-2-4-6-33-21-18(32)17(31)16(30)14(8-29)35-21/h7,10-11,14,16-18,21,29-32H,1-6,8-9H2,(H2,24,26,27)/t14-,16-,17+,18-,21-/m1/s1
InChIKey ZMMBMLJGFSVJRG-YUZRNDJPSA-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 588.474 g/mol
Sample ID 45160
Solvent DMSO-D6