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

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N-[(1R,2S,4R,5R)-2-(BENZYLOXYCARBONYLAMINO)-4-HYDROXY-5-(2-CHLOROETHOXY)-CYCLOHEXANE]-2,3,4-TRI-O-ACETYL-ALPHA-L-FUCOPYRANOSYLAMINE
SpectraBase Compound ID 91vudvw8c2a
InChI InChI=1S/C29H39ClN2O12/c1-15-24(42-16(2)33)25(43-17(3)34)26(44-18(4)35)28(41-15)32-27(37)20-12-23(39-11-10-30)22(36)13-21(20)31-29(38)40-14-19-8-6-5-7-9-19/h5-9,15,20-26,28,36H,10-14H2,1-4H3,(H,31,38)(H,32,37)/t15-,20-,21+,22-,23-,24+,25+,26-,28+/m0/s1
InChIKey CODCYICERBVPFY-YBGJGYAASA-N
Mol Weight 643.1 g/mol
Molecular Formula C29H39ClN2O12
Exact Mass 642.219152 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID TIU61eQvsG
Name N-[(1R,2S,4R,5R)-2-(BENZYLOXYCARBONYLAMINO)-4-HYDROXY-5-(2-CHLOROETHOXY)-CYCLOHEXANE]-2,3,4-TRI-O-ACETYL-ALPHA-L-FUCOPYRANOSYLAMINE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H39ClN2O12
InChI InChI=1S/C29H39ClN2O12/c1-15-24(42-16(2)33)25(43-17(3)34)26(44-18(4)35)28(41-15)32-27(37)20-12-23(39-11-10-30)22(36)13-21(20)31-29(38)40-14-19-8-6-5-7-9-19/h5-9,15,20-26,28,36H,10-14H2,1-4H3,(H,31,38)(H,32,37)/t15-,20-,21+,22-,23-,24+,25+,26-,28+/m0/s1
InChIKey CODCYICERBVPFY-YBGJGYAASA-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 643.088 g/mol
Solvent CDCl3
Source File Reference UWBT20543