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6-FLUORO-1-METHYL-7-(O-BETA-D-GLUCOPYRANOSYL)-CAMALEXIN
SpectraBase Compound ID AH5R2NNqfHk
InChI InChI=1S/C18H19FN2O6S/c1-21-6-9(17-20-4-5-28-17)8-2-3-10(19)16(12(8)21)27-18-15(25)14(24)13(23)11(7-22)26-18/h2-6,11,13-15,18,22-25H,7H2,1H3/t11-,13-,14+,15-,18+/m1/s1
InChIKey SPWLOXQABYTGSJ-YYZLIPTLSA-N
Mol Weight 410.42 g/mol
Molecular Formula C18H19FN2O6S
Exact Mass 410.094786 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H1IQ3KO3I7o
Name 6-FLUORO-1-METHYL-7-(O-BETA-D-GLUCOPYRANOSYL)-CAMALEXIN
Compound Number 5D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H19FN2O6S
InChI InChI=1S/C18H19FN2O6S/c1-21-6-9(17-20-4-5-28-17)8-2-3-10(19)16(12(8)21)27-18-15(25)14(24)13(23)11(7-22)26-18/h2-6,11,13-15,18,22-25H,7H2,1H3/t11-,13-,14+,15-,18+/m1/s1
InChIKey SPWLOXQABYTGSJ-YYZLIPTLSA-N
Literature Reference Author M.S.C.PEDRAS,P.W.K.AHIAHONU
Literature Reference Citation BIOORG.MED.CHEM.,10,3307(2002)
Literature Reference DOI 10.1016/S0968-0896(02)00208-0
Molecular Weight 410.417 g/mol
Sample ID 31300
Solvent CD3CN