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2,6-di-o-Acetyl-3,5-o-isopropylidene-1,1,6-tri-C-phenyl-D-glycero-D-gulo-hexitol
SpectraBase Compound ID 75jmVXTUY3p
InChI InChI=1S/C31H34O8/c1-20(32)36-26(22-14-8-5-9-15-22)27-25(34)28(39-30(3,4)38-27)29(37-21(2)33)31(35,23-16-10-6-11-17-23)24-18-12-7-13-19-24/h5-19,25-29,34-35H,1-4H3/t25-,26-,27-,28+,29+/m0/s1
InChIKey ICAINVMHCAQCAU-OTJWULCMSA-N
Mol Weight 534.6 g/mol
Molecular Formula C31H34O8
Exact Mass 534.225368 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4lmtvaG3twQ
Name 2,6-Di-O-Acetyl-3,5-O-isopropylidene-1,1,6-tri-C-phenyl-D-glycero-D-gulo-hexitol
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H34O8
InChI InChI=1S/C31H34O8/c1-20(32)36-26(22-14-8-5-9-15-22)27-25(34)28(39-30(3,4)38-27)29(37-21(2)33)31(35,23-16-10-6-11-17-23)24-18-12-7-13-19-24/h5-19,25-29,34-35H,1-4H3/t25-,26-,27-,28+,29+/m0/s1
InChIKey ICAINVMHCAQCAU-OTJWULCMSA-N
Molecular Weight 534.605 g/mol
SMILES OC([C@@]([C@@]1(OC(O[C@@]([C@@]1(O)[H])([C@@](OC(=O)C)(c1ccccc1)[H])[H])(C)C)[H])(OC(=O)C)[H])(c1ccccc1)c1ccccc1
SPLASH splash10-053r-1900000000-d388d498cd6a3f1ec0d7
Source of Spectrum J-60-3129-18
Synonyms (1S)-1,5-di-O-acetyl-2,4-O-(1-methylethylidene)-1,6,6-tri-C-phenyl-L-glucitol
Wiley ID 1403850