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(2'-S,3'-S)-1-D-3,6-DI-O-BENZYL-4,5-O-(2',3'-DIMETHOXYBUTANE-2',3'-DIYL)-1,2-O-[(2''-METHYLENE)-PROPANE-1'',3''-DIYL]-MYO-INOSITOL

View entire compound with spectra: 1 NMR

(2'-S,3'-S)-1-D-3,6-DI-O-BENZYL-4,5-O-(2',3'-DIMETHOXYBUTANE-2',3'-DIYL)-1,2-O-[(2''-METHYLENE)-PROPANE-1'',3''-DIYL]-MYO-INOSITOL
SpectraBase Compound ID 5Pi6wFLABhN
InChI InChI=1S/C30H38O8/c1-20-16-33-23-24(34-17-20)26(36-19-22-14-10-7-11-15-22)28-27(25(23)35-18-21-12-8-6-9-13-21)37-29(2,31-4)30(3,32-5)38-28/h6-15,23-28H,1,16-19H2,2-5H3/t23-,24+,25-,26-,27+,28+,29-,30-/m0/s1
InChIKey DTIHFHWMHIKLQE-QATYEVODSA-N
Mol Weight 526.6 g/mol
Molecular Formula C30H38O8
Exact Mass 526.256668 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EX02NW9sp5k
Name (2'-S,3'-S)-1-D-3,6-DI-O-BENZYL-4,5-O-(2',3'-DIMETHOXYBUTANE-2',3'-DIYL)-1,2-O-[(2''-METHYLENE)-PROPANE-1'',3''-DIYL]-MYO-INOSITOL
Compound Number 15
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H38O8
InChI InChI=1S/C30H38O8/c1-20-16-33-23-24(34-17-20)26(36-19-22-14-10-7-11-15-22)28-27(25(23)35-18-21-12-8-6-9-13-21)37-29(2,31-4)30(3,32-5)38-28/h6-15,23-28H,1,16-19H2,2-5H3/t23-,24+,25-,26-,27+,28+,29-,30-/m0/s1
InChIKey DTIHFHWMHIKLQE-QATYEVODSA-N
Literature Reference Author A.M.RILEY,V.CORREA,M.F.MAHON,C.W.TAYLOR,B.V.L.POTTER
Literature Reference Citation J.MED.CHEM.,44,2108(2001)
Literature Reference DOI 10.1021/jm0005499
Molecular Weight 526.627 g/mol
Sample ID 44546
Solvent CDCl3