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(+)-6-O-Benzyl-2,3-O-cyclohexylidene-1-O-(p-methoxybenzyl)-myo-inositol
SpectraBase Compound ID 2yDhhR93s0w
InChI InChI=1S/C27H34O7/c1-30-20-12-10-19(11-13-20)17-32-25-23(31-16-18-8-4-2-5-9-18)21(28)22(29)24-26(25)34-27(33-24)14-6-3-7-15-27/h2,4-5,8-13,21-26,28-29H,3,6-7,14-17H2,1H3/t21-,22-,23+,24+,25-,26+/m1/s1
InChIKey GLOLANWAWMDABA-RMLCQDLPSA-N
Mol Weight 470.6 g/mol
Molecular Formula C27H34O7
Exact Mass 470.230453 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IAUqcoe4SDg
Name (+)-6-O-Benzyl-2,3-O-cyclohexylidene-1-O-(p-methoxybenzyl)-myo-inositol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H34O7
InChI InChI=1S/C27H34O7/c1-30-20-12-10-19(11-13-20)17-32-25-23(31-16-18-8-4-2-5-9-18)21(28)22(29)24-26(25)34-27(33-24)14-6-3-7-15-27/h2,4-5,8-13,21-26,28-29H,3,6-7,14-17H2,1H3/t21-,22-,23+,24+,25-,26+/m1/s1
InChIKey GLOLANWAWMDABA-RMLCQDLPSA-N
Molecular Weight 470.562 g/mol
SMILES O[C@]1([C@]2([C@@]([C@@]([C@]([C@@]1(O)[H])(OCc1ccccc1)[H])(OCc1ccc(cc1)OC)[H])(OC1(O2)CCCCC1)[H])[H])[H]
SPLASH splash10-00di-0902200000-3d9ab94152d4a78e533a
Source of Spectrum J-61-5907-5
Synonyms (3aR,4R,5S,6R,7R,7aS)-5-(benzyloxy)-4-[(4-methoxyphenyl)methoxy]-hexahydrospiro[1,3-benzodioxole-2,1'-cyclohexane]-6,7-diol
Wiley ID 1392866