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Carbocyclic-dibenzyl-(2,3,4,6-tetra-o-benzyl-alpha-D-glucopyranosyl)-phosphate

View entire compound with spectra: 2 NMR

Carbocyclic-dibenzyl-(2,3,4,6-tetra-o-benzyl-alpha-D-glucopyranosyl)-phosphate
SpectraBase Compound ID DcSTfZdf1eZ
InChI InChI=1S/C49H51O8P/c50-58(55-36-43-27-15-5-16-28-43,56-37-44-29-17-6-18-30-44)57-46-31-45(38-51-32-39-19-7-1-8-20-39)47(52-33-40-21-9-2-10-22-40)49(54-35-42-25-13-4-14-26-42)48(46)53-34-41-23-11-3-12-24-41/h1-30,45-49H,31-38H2/t45-,46+,47-,48+,49+/m1/s1
InChIKey GPFSONRZVNUQOC-WXOBWUEKSA-N
Mol Weight 798.9 g/mol
Molecular Formula C49H51O8P
Exact Mass 798.332156 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7BzGWd74uxe
Name Carbocyclic-dibenzyl-(2,3,4,6-tetra-o-benzyl-alpha-D-glucopyranosyl)-phosphate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 798.332155592 u
Formula C49H51O8P
InChI InChI=1S/C49H51O8P/c50-58(55-36-43-27-15-5-16-28-43,56-37-44-29-17-6-18-30-44)57-46-31-45(38-51-32-39-19-7-1-8-20-39)47(52-33-40-21-9-2-10-22-40)49(54-35-42-25-13-4-14-26-42)48(46)53-34-41-23-11-3-12-24-41/h1-30,45-49H,31-38H2/t45-,46+,47-,48+,49+/m1/s1
InChIKey GPFSONRZVNUQOC-WXOBWUEKSA-N
Molecular Weight 798.913 g/mol
SMILES C(OCC1=CC=CC=C1)[C@@]1([C@]([C@@]([C@]([C@@](OP(=O)(OCC2=CC=CC=C2)OCC2=CC=CC=C2)(C1)[H])(OCC1=CC=CC=C1)[H])(OCC1=CC=CC=C1)[H])(OCC1=CC=CC=C1)[H])[H]