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METHYL-2,3,4-TRI-O-BENZYL-ALPHA-L-IDOPYRANOSIDURONATE-(1->4)-2-AZIDO-3,6-DI-O-BENZYL-2-DEOXY-D-GLUCOPYRANOSIDE-TRICHLOROACETIMIDATE
SpectraBase Compound ID 5TUdUSzua3K
InChI InChI=1S/C50H51Cl3N4O11/c1-59-46(58)44-42(62-29-35-21-11-4-12-22-35)43(63-30-36-23-13-5-14-24-36)45(64-31-37-25-15-6-16-26-37)48(67-44)66-40-38(32-60-27-33-17-7-2-8-18-33)65-47(68-49(54)50(51,52)53)39(56-57-55)41(40)61-28-34-19-9-3-10-20-34/h2-26,38-45,47-48,54H,27-32H2,1H3/t38-,39-,40-,41-,42+,43+,44-,45-,47+,48-/m0/s1
InChIKey GEZUTGPUYLUXEZ-QCMHEARRSA-N
Mol Weight 990.3 g/mol
Molecular Formula C50H51Cl3N4O11
Exact Mass 988.261992 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID MwM2Uf9QUD
Name METHYL-2,3,4-TRI-O-BENZYL-ALPHA-L-IDOPYRANOSIDURONATE-(1->4)-2-AZIDO-3,6-DI-O-BENZYL-2-DEOXY-D-GLUCOPYRANOSIDE-TRICHLOROACETIMIDATE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C50H51Cl3N4O11
InChI InChI=1S/C50H51Cl3N4O11/c1-59-46(58)44-42(62-29-35-21-11-4-12-22-35)43(63-30-36-23-13-5-14-24-36)45(64-31-37-25-15-6-16-26-37)48(67-44)66-40-38(32-60-27-33-17-7-2-8-18-33)65-47(68-49(54)50(51,52)53)39(56-57-55)41(40)61-28-34-19-9-3-10-20-34/h2-26,38-45,47-48,54H,27-32H2,1H3/t38-,39-,40-,41-,42+,43+,44-,45-,47+,48-/m0/s1
InChIKey GEZUTGPUYLUXEZ-QCMHEARRSA-N
Literature Reference Author G.J.S.LOHMAN,P.H.SEEBERGER
Literature Reference Citation J.ORG.CHEM.,69,4081(2004)
Literature Reference DOI 10.1021/jo035732z
Molecular Weight 990.334 g/mol
Solvent CDCl3
Source File Reference UWVN21636