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#2;MACROLIDE;3-O-DE-(2,6-DIDEOXY-3-C-METHYL-3-O-METHYL-ALPHA-L-RIBO-HEXOPYRANOSYL)-6-O-METHYL-ERYTHROMYCIN-2'-BENZOATE;(3R,4S,5S,6R,7R,9R,11R,12R,13S,14R)-14-E

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#2;MACROLIDE;3-O-DE-(2,6-DIDEOXY-3-C-METHYL-3-O-METHYL-ALPHA-L-RIBO-HEXOPYRANOSYL)-6-O-METHYL-ERYTHROMYCIN-2'-BENZOATE;(3R,4S,5S,6R,7R,9R,11R,12R,13S,14R)-14-E
SpectraBase Compound ID COzo2W4V5dw
InChI InChI=1S/C37H59NO11/c1-12-27-37(8,44)31(41)22(4)28(39)20(2)19-36(7,45-11)32(23(5)29(40)24(6)33(42)47-27)49-35-30(26(38(9)10)18-21(3)46-35)48-34(43)25-16-14-13-15-17-25/h13-17,20-24,26-27,29-32,35,40-41,44H,12,18-19H2,1-11H3/t20-,21-,22+,23+,24-,26+,27-,29+,30-,31-,32-,35+,36-,37-/m1/s1
InChIKey JXRDRIKAOUPLPM-SVDPFKKKSA-N
Mol Weight 693.9 g/mol
Molecular Formula C37H59NO11
Exact Mass 693.408812 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 182hZu6JFa6
Name #2;MACROLIDE;3-O-DE-(2,6-DIDEOXY-3-C-METHYL-3-O-METHYL-ALPHA-L-RIBO-HEXOPYRANOSYL)-6-O-METHYL-ERYTHROMYCIN-2'-BENZOATE;(3R,4S,5S,6R,7R,9R,11R,12R,13S,14R)-14-E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H59NO11
InChI InChI=1S/C37H59NO11/c1-12-27-37(8,44)31(41)22(4)28(39)20(2)19-36(7,45-11)32(23(5)29(40)24(6)33(42)47-27)49-35-30(26(38(9)10)18-21(3)46-35)48-34(43)25-16-14-13-15-17-25/h13-17,20-24,26-27,29-32,35,40-41,44H,12,18-19H2,1-11H3/t20-,21-,22+,23+,24-,26+,27-,29+,30-,31-,32-,35+,36-,37-/m1/s1
InChIKey JXRDRIKAOUPLPM-SVDPFKKKSA-N
Literature Reference Author N.MUNIGELA,J.M.BABU,A.YERRAMILLI,G.SINGH,B.REDDY,M.TAKHI,L.K .TATINI
Literature Reference Citation SCI.PHARM.,77,775(2009)
Molecular Weight 693.876 g/mol
Sample ID 2974
Solvent CDCl3