| SpectraBase Spectrum ID |
HhXDg9DjkPk |
| Name |
Benzyl .beta.-D-ribofuranoside tribenzoate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
552.178417854 u |
| Formula |
C33H28O8 |
| InChI |
InChI=1S/C33H28O8/c34-30(24-15-7-2-8-16-24)37-22-27-28(40-31(35)25-17-9-3-10-18-25)29(41-32(36)26-19-11-4-12-20-26)33(39-27)38-21-23-13-5-1-6-14-23/h1-20,27-29,33H,21-22H2/t27-,28-,29-,33-/m1/s1 |
| InChIKey |
YTXMDSQXQRTXIM-OZLMZZSTSA-N |
| Molecular Weight |
552.579 g/mol |
| SMILES |
[C@@]1([C@@]([C@@](COC(=O)C2=CC=CC=C2)(O[C@]1(OCC1=CC=CC=C1)[H])[H])(OC(=O)C1=CC=CC=C1)[H])(OC(=O)C1=CC=CC=C1)[H] |
