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N-[(1R,2S,4S,5S)-2-(3-ACETOXYBENZAMIDO)-4-(2-CHLOROETHOXY)-5-HYDROXYCYCLOHEXANE]-2,3,4-TRI-O-ACETYL-ALPHA-L-FUCOPYRANOSYLAMINE

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N-[(1R,2S,4S,5S)-2-(3-ACETOXYBENZAMIDO)-4-(2-CHLOROETHOXY)-5-HYDROXYCYCLOHEXANE]-2,3,4-TRI-O-ACETYL-ALPHA-L-FUCOPYRANOSYLAMINE
SpectraBase Compound ID IFbofv029hr
InChI InChI=1S/C30H39ClN2O13/c1-14-25(44-16(3)35)26(45-17(4)36)27(46-18(5)37)30(42-14)33-29(40)21-12-23(38)24(41-10-9-31)13-22(21)32-28(39)19-7-6-8-20(11-19)43-15(2)34/h6-8,11,14,21-27,30,38H,9-10,12-13H2,1-5H3,(H,32,39)(H,33,40)/t14-,21-,22+,23+,24+,25+,26+,27-,30+/m0/s1
InChIKey AOCZPULPHOURLX-LXPDXMMISA-N
Mol Weight 671.1 g/mol
Molecular Formula C30H39ClN2O13
Exact Mass 670.214067 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LkLBLs6tCT9
Name N-[(1R,2S,4S,5S)-2-(3-ACETOXYBENZAMIDO)-4-(2-CHLOROETHOXY)-5-HYDROXYCYCLOHEXANE]-2,3,4-TRI-O-ACETYL-ALPHA-L-FUCOPYRANOSYLAMINE
Compound Number 15
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H39ClN2O13
InChI InChI=1S/C30H39ClN2O13/c1-14-25(44-16(3)35)26(45-17(4)36)27(46-18(5)37)30(42-14)33-29(40)21-12-23(38)24(41-10-9-31)13-22(21)32-28(39)19-7-6-8-20(11-19)43-15(2)34/h6-8,11,14,21-27,30,38H,9-10,12-13H2,1-5H3,(H,32,39)(H,33,40)/t14-,21-,22+,23+,24+,25+,26+,27-,30+/m0/s1
InChIKey AOCZPULPHOURLX-LXPDXMMISA-N
Literature Reference Author D.DOKNIC,M.ABRAMO,I.SUTKEVICIUTE,A.REINHARDT,C.GUZZI,M.K.SCH LEGEL,D.POTENZA
Literature Reference Citation EUR.J.ORG.CHEM.,2013,5303(2013)
Literature Reference DOI 10.1002/ejoc.201300236
Molecular Weight 671.098 g/mol
Solvent CDCl3
Source File Reference UWBT20544