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1-BETA,1'-BETA-(2,2'-BIFURAN-5,5'-DIYL)-BIS-(1,2-DIDEOXY-3,5-DI-O-TOLUOYL-D-RIBOFURANOSIDE)
SpectraBase Compound ID 4mhqQdHuRKI
InChI InChI=1S/C50H46O12/c1-29-5-13-33(14-6-29)47(51)55-27-45-43(61-49(53)35-17-9-31(3)10-18-35)25-41(59-45)39-23-21-37(57-39)38-22-24-40(58-38)42-26-44(62-50(54)36-19-11-32(4)12-20-36)46(60-42)28-56-48(52)34-15-7-30(2)8-16-34/h5-24,41-46H,25-28H2,1-4H3/t41-,42-,43-,44+,45+,46-/m0/s1
InChIKey WWOQOGZCEYHZOC-ZIQAYJEZSA-N
Mol Weight 838.9 g/mol
Molecular Formula C50H46O12
Exact Mass 838.298927 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FHxbii2agnv
Name 1-BETA,1'-BETA-(2,2'-BIFURAN-5,5'-DIYL)-BIS-(1,2-DIDEOXY-3,5-DI-O-TOLUOYL-D-RIBOFURANOSIDE)
Compound Number 11A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C50H46O12
InChI InChI=1S/C50H46O12/c1-29-5-13-33(14-6-29)47(51)55-27-45-43(61-49(53)35-17-9-31(3)10-18-35)25-41(59-45)39-23-21-37(57-39)38-22-24-40(58-38)42-26-44(62-50(54)36-19-11-32(4)12-20-36)46(60-42)28-56-48(52)34-15-7-30(2)8-16-34/h5-24,41-46H,25-28H2,1-4H3/t41-,42-,43-,44+,45+,46-/m0/s1
InChIKey WWOQOGZCEYHZOC-ZIQAYJEZSA-N
Literature Reference Author J.BARTA,L.SLAVETINSKA,B.KLEPETAROVA,M.HOCEK
Literature Reference Citation EUR.J.ORG.CHEM.,2010,5432(2010)
Literature Reference DOI 10.1002/ejoc.201000726
Molecular Weight 838.908 g/mol
Solvent ACETONE-D6
Source File Reference UWLU85797