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2,3,4,6-TETRA-O-ACETYL-7-O-(3,4,6-TRI-O-ACETYL-2-DEOXY-2-PHTHALIMIDO-BETA-D-GLUCOPYRANOSYL)-L-GLYCERO-ALPHA,BETA-D-MANNO-
SpectraBase Compound ID 4WBPGVv6Byz
InChI InChI=1S/C37H41Cl3N2O20/c1-14(43)52-12-24-26(55-16(3)45)28(56-17(4)46)25(42-32(50)21-10-8-9-11-22(21)33(42)51)34(60-24)53-13-23(54-15(2)44)27-29(57-18(5)47)30(58-19(6)48)31(59-20(7)49)35(61-27)62-36(41)37(38,39)40/h8-11,23-31,34-35,41H,12-13H2,1-7H3/t23-,24-,25-,26-,27+,28-,29+,30-,31-,34-,35+/m1/s1
InChIKey BRTNNVKGIYAOGS-CRQGHBDCSA-N
Mol Weight 940.1 g/mol
Molecular Formula C37H41Cl3N2O20
Exact Mass 938.131825 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DW47LcodvZq
Name 2,3,4,6-TETRA-O-ACETYL-7-O-(3,4,6-TRI-O-ACETYL-2-DEOXY-2-PHTHALIMIDO-BETA-D-GLUCOPYRANOSYL)-L-GLYCERO-ALPHA,BETA-D-MANNO-
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H41Cl3N2O20
InChI InChI=1S/C37H41Cl3N2O20/c1-14(43)52-12-24-26(55-16(3)45)28(56-17(4)46)25(42-32(50)21-10-8-9-11-22(21)33(42)51)34(60-24)53-13-23(54-15(2)44)27-29(57-18(5)47)30(58-19(6)48)31(59-20(7)49)35(61-27)62-36(41)37(38,39)40/h8-11,23-31,34-35,41H,12-13H2,1-7H3/t23-,24-,25-,26-,27+,28-,29+,30-,31-,34-,35+/m1/s1
InChIKey BRTNNVKGIYAOGS-CRQGHBDCSA-N
Literature Reference Author K.V.ANTONOV,L.V.BACKINOWSKY,B.GRZESZCZYK,L.BRADE,O.HOLST,A.Z AMOJSKI
Literature Reference Citation CARBOHYDR.RES.,314,85(1998)
Literature Reference DOI 10.1016/S0008-6215(98)00292-4
Molecular Weight 940.093 g/mol
Solvent CDCl3
Source File Reference UWMP675