SpectraBase Spectrum ID |
LPNhHzpW50A |
Name |
N-Acetyl-tribenzylgalactosamine |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
491.230787781 u |
Formula |
C29H33NO6 |
InChI |
InChI=1S/C29H33NO6/c1-21(31)30-26-28(35-19-24-15-9-4-10-16-24)27(34-18-23-13-7-3-8-14-23)25(36-29(26)32)20-33-17-22-11-5-2-6-12-22/h2-16,25-29,32H,17-20H2,1H3,(H,30,31) |
InChIKey |
BMOPHWKYXVHVMF-UHFFFAOYSA-N |
Molecular Weight |
491.584 g/mol |
SMILES |
C1(C(C(OCC2=CC=CC=C2)C(OC1O)COCC1=CC=CC=C1)OCC1=CC=CC=C1)NC(C)=O |