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(-)-2,3-di-O-benzyl-1-O-(p-methoxybenzyl)-myo-inositol
SpectraBase Compound ID 1Vx5KVqJSpZ
InChI InChI=1S/C28H32O7/c1-32-22-14-12-21(13-15-22)18-34-27-25(31)23(29)24(30)26(33-16-19-8-4-2-5-9-19)28(27)35-17-20-10-6-3-7-11-20/h2-15,23-31H,16-18H2,1H3/t23-,24-,25+,26+,27-,28+/m1/s1
InChIKey NYDFJQOTTPGXBH-NUFRCSJQSA-N
Mol Weight 480.6 g/mol
Molecular Formula C28H32O7
Exact Mass 480.214803 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6qFgV6PmbKi
Name (-)-2,3-di-O-benzyl-1-O-(p-methoxybenzyl)-myo-inositol
Alternate Name(s) (1S,2R,3R,4S,5S,6R)-4,5-bis(benzyloxy)-6-[(4-methoxybenzyl)oxy]-1,2,3-cyclohexanetriol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H32O7
InChI InChI=1S/C28H32O7/c1-32-22-14-12-21(13-15-22)18-34-27-25(31)23(29)24(30)26(33-16-19-8-4-2-5-9-19)28(27)35-17-20-10-6-3-7-11-20/h2-15,23-31H,16-18H2,1H3/t23-,24-,25+,26+,27-,28+/m1/s1
InChIKey NYDFJQOTTPGXBH-NUFRCSJQSA-N
Molecular Weight 480.557 g/mol
SMILES O[C@@]1([C@]([C@]([C@]([C@@]([C@]1(O)[H])(O)[H])(OCc1ccccc1)[H])(OCc1ccccc1)[H])(OCc1ccc(cc1)OC)[H])[H]
SPLASH splash10-0006-9000000000-d8dff434914cc0bbab98
Source of Spectrum J-63-5436-30
Wiley ID 1395247