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(2S,3S,4R)-2-AZIDO-3,4-DI-O-BENZYL-1-O-(3,4,6-TRI-O-BENZYL-2-DEOXY-2-FLUORO-ALPHA-D-GALACTOPYRANOSYL)-1,3,4-OCTADECANETRIOL

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(2S,3S,4R)-2-AZIDO-3,4-DI-O-BENZYL-1-O-(3,4,6-TRI-O-BENZYL-2-DEOXY-2-FLUORO-ALPHA-D-GALACTOPYRANOSYL)-1,3,4-OCTADECANETRIOL
SpectraBase Compound ID 9684B2S3YDX
InChI InChI=1S/C45H64FN3O7/c1-2-3-4-5-6-7-8-9-10-11-12-22-29-39(50)42(51)38(48-49-47)33-55-45-41(46)44(54-32-37-27-20-15-21-28-37)43(53-31-36-25-18-14-19-26-36)40(56-45)34-52-30-35-23-16-13-17-24-35/h13-21,23-28,38-45,50-51H,2-12,22,29-34H2,1H3/t38-,39+,40-,41-,42-,43+,44-,45+/m1/s1
InChIKey ZFKPQNGHQHDTCT-BELRMARBSA-N
Mol Weight 778.0 g/mol
Molecular Formula C45H64FN3O7
Exact Mass 777.47283 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4cEEAhmWv7U
Name (2S,3S,4R)-2-AZIDO-3,4-DI-O-BENZYL-1-O-(3,4,6-TRI-O-BENZYL-2-DEOXY-2-FLUORO-ALPHA-D-GALACTOPYRANOSYL)-1,3,4-OCTADECANETRIOL
Compound Number 10-ALPHA
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C45H64FN3O7
InChI InChI=1S/C45H64FN3O7/c1-2-3-4-5-6-7-8-9-10-11-12-22-29-39(50)42(51)38(48-49-47)33-55-45-41(46)44(54-32-37-27-20-15-21-28-37)43(53-31-36-25-18-14-19-26-36)40(56-45)34-52-30-35-23-16-13-17-24-35/h13-21,23-28,38-45,50-51H,2-12,22,29-34H2,1H3/t38-,39+,40-,41-,42-,43+,44-,45+/m1/s1
InChIKey ZFKPQNGHQHDTCT-BELRMARBSA-N
Literature Reference Author L.BARBIERI,V.COSTANTINO,E.FATTORUSSO,A.MANGONI,N.BASILICO,M. MONDANI,D.TARAMELLI
Literature Reference Citation EUR.J.ORG.CHEM.,3279(2005)
Molecular Weight 778.017 g/mol
Sample ID 30047
Solvent CDCl3