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N-Acetyl-tetrabenzyl glucosamine

View entire compound with spectra: 1 NMR

N-Acetyl-tetrabenzyl glucosamine
SpectraBase Compound ID 11ZbnLzrhhf
InChI InChI=1S/C36H39NO6/c1-28(39)37-33(22-38)35(42-25-31-18-10-4-11-19-31)36(43-26-32-20-12-5-13-21-32)34(41-24-30-16-8-3-9-17-30)27-40-23-29-14-6-2-7-15-29/h2-22,33-36H,23-27H2,1H3,(H,37,39)
InChIKey MBIZAJRSFIAXRU-UHFFFAOYSA-N
Mol Weight 581.7 g/mol
Molecular Formula C36H39NO6
Exact Mass 581.277738 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8AesM20TOpW
Name N-Acetyl-tetrabenzyl glucosamine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 581.277737974 u
Formula C36H39NO6
InChI InChI=1S/C36H39NO6/c1-28(39)37-33(22-38)35(42-25-31-18-10-4-11-19-31)36(43-26-32-20-12-5-13-21-32)34(41-24-30-16-8-3-9-17-30)27-40-23-29-14-6-2-7-15-29/h2-22,33-36H,23-27H2,1H3,(H,37,39)
InChIKey MBIZAJRSFIAXRU-UHFFFAOYSA-N
Molecular Weight 581.709 g/mol
SMILES C(C(C(NC(=O)C)C=O)OCC1=CC=CC=C1)(C(OCC1=CC=CC=C1)COCC1=CC=CC=C1)OCC1=CC=CC=C1