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METHYL-2-ACETAMIDO-2,6-DIDEOXY-6-FLUORO-4-O-[2-O-(ALPHA-L-FUCOPYRANOSYL)-BETA-D-GALACTOPYRANOSYL]-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID Dh1wGskXOx0
InChI InChI=1S/C21H36FNO14/c1-6-11(26)14(29)16(31)20(33-6)37-18-15(30)12(27)9(5-24)35-21(18)36-17-8(4-22)34-19(32-3)10(13(17)28)23-7(2)25/h6,8-21,24,26-31H,4-5H2,1-3H3,(H,23,25)/t6-,8-,9+,10-,11+,12-,13-,14+,15-,16-,17-,18+,19-,20-,21-/m0/s1
InChIKey XVYGKSBBKQHBMQ-XYNBHAIMSA-N
Mol Weight 545.5 g/mol
Molecular Formula C21H36FNO14
Exact Mass 545.211983 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B6RCdp27vqV
Name METHYL-2-ACETAMIDO-2,6-DIDEOXY-6-FLUORO-4-O-[2-O-(ALPHA-L-FUCOPYRANOSYL)-BETA-D-GALACTOPYRANOSYL]-BETA-D-GLUCOPYRANOSIDE
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H36FNO14
InChI InChI=1S/C21H36FNO14/c1-6-11(26)14(29)16(31)20(33-6)37-18-15(30)12(27)9(5-24)35-21(18)36-17-8(4-22)34-19(32-3)10(13(17)28)23-7(2)25/h6,8-21,24,26-31H,4-5H2,1-3H3,(H,23,25)/t6-,8-,9+,10-,11+,12-,13-,14+,15-,16-,17-,18+,19-,20-,21-/m0/s1
InChIKey XVYGKSBBKQHBMQ-XYNBHAIMSA-N
Literature Reference Author E.PETRAKOVA,U.SPOHR,R.U.LEMIEUX
Literature Reference Citation CAN.J.CHEM.,70,233(1992)
Literature Reference DOI 10.1139/v92-034
Molecular Weight 545.514 g/mol
Solvent D2O
Source File Reference UWVP5341