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4,5,6-Tri-O-Benzyl-3-deoxy-1-O-(methoxymethyl)-myo-inositol
SpectraBase Compound ID CAscVLjylvN
InChI InChI=1S/C29H34O6/c1-31-21-35-27-25(30)17-26(32-18-22-11-5-2-6-12-22)28(33-19-23-13-7-3-8-14-23)29(27)34-20-24-15-9-4-10-16-24/h2-16,25-30H,17-21H2,1H3/t25-,26-,27-,28+,29+/m1/s1
InChIKey VWBGHPVWNPBNJF-DKHHQXCASA-N
Mol Weight 478.6 g/mol
Molecular Formula C29H34O6
Exact Mass 478.235539 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GyvkjWRP8Ju
Name 4,5,6-Tri-O-Benzyl-3-deoxy-1-O-(methoxymethyl)-myo-inositol
Alternate Name(s) 1D-4,5,6-Tri-O-Benzyl-3-deoxy-1-O-(methoxymethyl)-myo-inositol 3,4,5-tris(benzyloxy)-2-(methoxymethoxy)cyclohexanol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H34O6
InChI InChI=1S/C29H34O6/c1-31-21-35-27-25(30)17-26(32-18-22-11-5-2-6-12-22)28(33-19-23-13-7-3-8-14-23)29(27)34-20-24-15-9-4-10-16-24/h2-16,25-30H,17-21H2,1H3/t25-,26-,27-,28+,29+/m1/s1
InChIKey VWBGHPVWNPBNJF-DKHHQXCASA-N
Molecular Weight 478.585 g/mol
SMILES O[C@]1([C@]([C@@]([C@]([C@](OCc2ccccc2)(C1)[H])(OCc1ccccc1)[H])(OCc1ccccc1)[H])(OCOC)[H])[H]
SPLASH splash10-0007-9000000000-f14938474bf9ed6107a2
Source of Spectrum F-54-14908-9
Wiley ID 804379