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#23;1,3,4,6-TETRA-O-ACETYL-2-O-[4,6-DI-O-ACETYL-3-O-(2,3,4,6-TETRA-O-ACETYL-ALPHA-D-MANNOPYRANOSYL)-2-O-BENZOYL-ALPHA-D-MANNOPYRANOSYL]-BETA-D-MANNOPYRA
SpectraBase Compound ID KLLBZtyeokX
InChI InChI=1S/C45H56O27/c1-19(46)57-16-30-34(61-23(5)50)37(64-26(8)53)41(43(67-30)66-28(10)55)72-45-40(70-42(56)29-14-12-11-13-15-29)38(35(62-24(6)51)32(69-45)18-59-21(3)48)71-44-39(65-27(9)54)36(63-25(7)52)33(60-22(4)49)31(68-44)17-58-20(2)47/h11-15,30-41,43-45H,16-18H2,1-10H3/t30-,31+,32+,33+,34-,35+,36-,37+,38-,39-,40-,41+,43-,44+,45+/m0/s1
InChIKey WZUDHGAMDHWWCT-RUYXIMLWSA-N
Mol Weight 1028.9 g/mol
Molecular Formula C45H56O27
Exact Mass 1028.300897 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6DDw56HIdIW
Name #23;1,3,4,6-TETRA-O-ACETYL-2-O-[4,6-DI-O-ACETYL-3-O-(2,3,4,6-TETRA-O-ACETYL-ALPHA-D-MANNOPYRANOSYL)-2-O-BENZOYL-ALPHA-D-MANNOPYRANOSYL]-BETA-D-MANNOPYRA
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C45H56O27
InChI InChI=1S/C45H56O27/c1-19(46)57-16-30-34(61-23(5)50)37(64-26(8)53)41(43(67-30)66-28(10)55)72-45-40(70-42(56)29-14-12-11-13-15-29)38(35(62-24(6)51)32(69-45)18-59-21(3)48)71-44-39(65-27(9)54)36(63-25(7)52)33(60-22(4)49)31(68-44)17-58-20(2)47/h11-15,30-41,43-45H,16-18H2,1-10H3/t30-,31+,32+,33+,34-,35+,36-,37+,38-,39-,40-,41+,43-,44+,45+/m0/s1
InChIKey WZUDHGAMDHWWCT-RUYXIMLWSA-N
Literature Reference Author C.CARPENTER,S.A.NEPOGODIEV
Literature Reference Citation EUR.J.ORG.CHEM.,3286(2005)
Molecular Weight 1028.923 g/mol
Sample ID 30063
Solvent CDCl3