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2-Acetamido-1-o-benzoyl-tetra-o-benzyl-.alpha.-D-glucopyranose

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2-Acetamido-1-o-benzoyl-tetra-o-benzyl-.alpha.-D-glucopyranose
SpectraBase Compound ID DnirBZdCvq6
InChI InChI=1S/C36H37NO6/c1-26(2)37-32-34(41-24-28-17-9-4-10-18-28)33(40-23-27-15-7-3-8-16-27)31(25-39-30-21-13-6-14-22-30)42-36(32)43-35(38)29-19-11-5-12-20-29/h3-22,31-34,36-37H,1,23-25H2,2H3/t31-,32-,33+,34+,36+/m0/s1
InChIKey HRWCGOMXYPWTTK-GTNSXXPVSA-N
Mol Weight 579.7 g/mol
Molecular Formula C36H37NO6
Exact Mass 579.262088 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FlaK0k7QUDV
Name 2-Acetamido-1-o-benzoyl-tetra-o-benzyl-.alpha.-D-glucopyranose
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 579.262087909 u
Formula C36H37NO6
InChI InChI=1S/C36H37NO6/c1-26(2)37-32-34(41-24-28-17-9-4-10-18-28)33(40-23-27-15-7-3-8-16-27)31(25-39-30-21-13-6-14-22-30)42-36(32)43-35(38)29-19-11-5-12-20-29/h3-22,31-34,36-37H,1,23-25H2,2H3/t31-,32-,33+,34+,36+/m0/s1
InChIKey HRWCGOMXYPWTTK-GTNSXXPVSA-N
Molecular Weight 579.693 g/mol
SMILES [C@@]1([C@@](O[C@@]([C@]([C@]1(OCC1=CC=CC=C1)[H])(NC(=C)C)[H])(OC(=O)C1=CC=CC=C1)[H])(COC1=CC=CC=C1)[H])(OCC1=CC=CC=C1)[H]