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#9;PARA-(2-METHOXYCARBONYLETHYL)-PHENYL-O-(2,4-DI-O-ACETYL-3,6-DI-O-METHYL-BETA-D-GLUCOPYRANOSYL)-(1->4)-O-(2,3-DI-O-METHYL-ALPHA-L-RHAMNOPYRANOSYL)-(1->2)-4-O
SpectraBase Compound ID EzB1UetoeT9
InChI InChI=1S/C44H62O18/c1-24-33(54-22-29-14-12-11-13-15-29)36(50-7)41(43(55-24)59-30-19-16-28(17-20-30)18-21-32(47)49-6)62-42-39(53-10)37(51-8)34(25(2)56-42)61-44-40(58-27(4)46)38(52-9)35(57-26(3)45)31(60-44)23-48-5/h11-17,19-20,24-25,31,33-44H,18,21-23H2,1-10H3/t24-,25-,31+,33-,34-,35+,36+,37+,38-,39+,40+,41+,42-,43-,44-/m1/s1
InChIKey SHZOXSRAKKHGCI-AJXVCPCCSA-N
Mol Weight 879.0 g/mol
Molecular Formula C44H62O18
Exact Mass 878.393615 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KhvjoAWVpPD
Name #9;PARA-(2-METHOXYCARBONYLETHYL)-PHENYL-O-(2,4-DI-O-ACETYL-3,6-DI-O-METHYL-BETA-D-GLUCOPYRANOSYL)-(1->4)-O-(2,3-DI-O-METHYL-ALPHA-L-RHAMNOPYRANOSYL)-(1->2)-4-O
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C44H62O18
InChI InChI=1S/C44H62O18/c1-24-33(54-22-29-14-12-11-13-15-29)36(50-7)41(43(55-24)59-30-19-16-28(17-20-30)18-21-32(47)49-6)62-42-39(53-10)37(51-8)34(25(2)56-42)61-44-40(58-27(4)46)38(52-9)35(57-26(3)45)31(60-44)23-48-5/h11-17,19-20,24-25,31,33-44H,18,21-23H2,1-10H3/t24-,25-,31+,33-,34-,35+,36+,37+,38-,39+,40+,41+,42-,43-,44-/m1/s1
InChIKey SHZOXSRAKKHGCI-AJXVCPCCSA-N
Literature Reference Author T.FUJIWARA,S.IZUMI
Literature Reference Citation AGR.BIOL.CHEM.,51,2539(1987)
Literature Reference DOI 10.1271/bbb1961.51.2539
Molecular Weight 878.965 g/mol
Solvent CDCl3
Source File Reference UWBT8184