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

View entire compound with spectra: 2 NMR

PARA-OCTYLOXYPHENYL-2,3,4-TRI-O-BENZYL-BETA-D-GLUCOPYRANOSYL-SULFOXIDE;MAJOR-COMPONENT
SpectraBase Compound ID EpwJStpHm9m
InChI InChI=1S/C41H50O7S/c1-2-3-4-5-6-16-27-44-35-23-25-36(26-24-35)49(43)41-40(47-31-34-21-14-9-15-22-34)39(46-30-33-19-12-8-13-20-33)38(37(28-42)48-41)45-29-32-17-10-7-11-18-32/h7-15,17-26,37-42H,2-6,16,27-31H2,1H3/t37-,38-,39+,40-,41+,49?/m1/s1
InChIKey HTJVOUAPEVCNLU-UTNZUPSMSA-N
Mol Weight 686.9 g/mol
Molecular Formula C41H50O7S
Exact Mass 686.327725 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5tUZj0ded4
Name PARA-OCTYLOXYPHENYL-2,3,4-TRI-O-BENZYL-BETA-D-GLUCOPYRANOSYL-SULFOXIDE;MAJOR-COMPONENT
Compound Number 5A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C41H50O7S
InChI InChI=1S/C41H50O7S/c1-2-3-4-5-6-16-27-44-35-23-25-36(26-24-35)49(43)41-40(47-31-34-21-14-9-15-22-34)39(46-30-33-19-12-8-13-20-33)38(37(28-42)48-41)45-29-32-17-10-7-11-18-32/h7-15,17-26,37-42H,2-6,16,27-31H2,1H3/t37-,38-,39+,40-,41+,49?/m1/s1
InChIKey HTJVOUAPEVCNLU-UTNZUPSMSA-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 686.904 g/mol
Source File Reference UWBT4070