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1-BETA-[2-ACETYL-2-(ETHOXYCARBONYL)-1,3-DIHYDRO-2H-INDEN-5-YL]-1,2-DIDEOXY-3,5-DI-O-(4-TOLUOYL)]-D-RIBOFURANOSIDE
SpectraBase Compound ID 51frTaSZgYd
InChI InChI=1S/2C35H36O8/c2*1-5-40-34(39)35(23(4)36)18-27-15-14-26(16-28(27)19-35)29-17-30(43-33(38)25-12-8-22(3)9-13-25)31(42-29)20-41-32(37)24-10-6-21(2)7-11-24/h2*6-16,29-31H,5,17-20H2,1-4H3/t29-,30+,31-,35+;29-,30+,31-,35-/m11/s1
InChIKey HYSKRPACFVPELG-KHSUCYECSA-N
Mol Weight 1169.3 g/mol
Molecular Formula C70H72O16
Exact Mass 1168.482036 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9qWcrCc422C
Name 1-BETA-[2-ACETYL-2-(ETHOXYCARBONYL)-1,3-DIHYDRO-2H-INDEN-5-YL]-1,2-DIDEOXY-3,5-DI-O-(4-TOLUOYL)]-D-RIBOFURANOSIDE
Compound Number 3-BETA-C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C70H72O16
InChI InChI=1S/2C35H36O8/c2*1-5-40-34(39)35(23(4)36)18-27-15-14-26(16-28(27)19-35)29-17-30(43-33(38)25-12-8-22(3)9-13-25)31(42-29)20-41-32(37)24-10-6-21(2)7-11-24/h2*6-16,29-31H,5,17-20H2,1-4H3/t29-,30+,31-,35+;29-,30+,31-,35-/m11/s1
InChIKey HYSKRPACFVPELG-KHSUCYECSA-N
Literature Reference Author P.NOVAK,R.POHL,M.KOTORA,M.HOCEK
Literature Reference Citation ORG.LETTERS,8,2051(2006)
Literature Reference DOI 10.1021/ol060454m
Molecular Weight 1169.332 g/mol
Sample ID 59708
Solvent C6D6