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PARA-OCTYLOXYPHENYL-2,3,4-TRI-O-BENZOYL-BETA-D-GLUCOPYRANOSYL-SULFOXIDE;MAJOR-COMPONENT

View entire compound with spectra: 2 NMR

PARA-OCTYLOXYPHENYL-2,3,4-TRI-O-BENZOYL-BETA-D-GLUCOPYRANOSYL-SULFOXIDE;MAJOR-COMPONENT
SpectraBase Compound ID CeLILwIlY0F
InChI InChI=1S/C41H44O10S/c1-2-3-4-5-6-16-27-47-32-23-25-33(26-24-32)52(46)41-37(51-40(45)31-21-14-9-15-22-31)36(50-39(44)30-19-12-8-13-20-30)35(34(28-42)48-41)49-38(43)29-17-10-7-11-18-29/h7-15,17-26,34-37,41-42H,2-6,16,27-28H2,1H3/t34-,35-,36+,37-,41+,52?/m0/s1
InChIKey TTYLJMWFUKZYCF-VSDOPYAZSA-N
Mol Weight 728.9 g/mol
Molecular Formula C41H44O10S
Exact Mass 728.265519 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LpsApmqwuWj
Name PARA-OCTYLOXYPHENYL-2,3,4-TRI-O-BENZOYL-BETA-D-GLUCOPYRANOSYL-SULFOXIDE;MAJOR-COMPONENT
Compound Number 5B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C41H44O10S
InChI InChI=1S/C41H44O10S/c1-2-3-4-5-6-16-27-47-32-23-25-33(26-24-32)52(46)41-37(51-40(45)31-21-14-9-15-22-31)36(50-39(44)30-19-12-8-13-20-30)35(34(28-42)48-41)49-38(43)29-17-10-7-11-18-29/h7-15,17-26,34-37,41-42H,2-6,16,27-28H2,1H3/t34-,35-,36+,37-,41+,52?/m0/s1
InChIKey TTYLJMWFUKZYCF-VSDOPYAZSA-N
Literature Reference Author T.KAJIMOTO,K.ARMITSU,M.OZEKI,M.NODE
Literature Reference Citation CHEM.PHARM.BULL.,58,758(2010)
Literature Reference DOI 10.1248/cpb.58.758
Molecular Weight 728.854 g/mol
Source File Reference UWBT4072