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METHYL-3-AZIDO-4,5,7-TRI-O-BENZYL-2,3-DIDEOXY-2-ETHYLTHIO-ALPHA-D-MANNOHEPT-2-ULOPYRANOSONATE
SpectraBase Compound ID 5q7kZ73KF9
InChI InChI=1S/C31H35N3O6S/c1-3-41-31(30(35)36-2)29(33-34-32)28(39-21-25-17-11-6-12-18-25)27(38-20-24-15-9-5-10-16-24)26(40-31)22-37-19-23-13-7-4-8-14-23/h4-18,26-29H,3,19-22H2,1-2H3/t26-,27-,28+,29+,31+/m0/s1
InChIKey KGSFHQIBQGPZNY-STSTVOBVSA-N
Mol Weight 577.7 g/mol
Molecular Formula C31H35N3O6S
Exact Mass 577.224657 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C16ttZnycK1
Name METHYL-3-AZIDO-4,5,7-TRI-O-BENZYL-2,3-DIDEOXY-2-ETHYLTHIO-ALPHA-D-MANNOHEPT-2-ULOPYRANOSONATE
Compound Number 38
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H35N3O6S
InChI InChI=1S/C31H35N3O6S/c1-3-41-31(30(35)36-2)29(33-34-32)28(39-21-25-17-11-6-12-18-25)27(38-20-24-15-9-5-10-16-24)26(40-31)22-37-19-23-13-7-4-8-14-23/h4-18,26-29H,3,19-22H2,1-2H3/t26-,27-,28+,29+,31+/m0/s1
InChIKey KGSFHQIBQGPZNY-STSTVOBVSA-N
Literature Reference Author F.STOLZ,M.REINER,A.BLUME,W.REUTTER,R.R.SCHMIDT
Literature Reference Citation J.ORG.CHEM.,69,665(2004)
Literature Reference DOI 10.1021/jo0353029
Molecular Weight 577.695 g/mol
Solvent CDCl3
Source File Reference UWVN21528