| SpectraBase Spectrum ID |
JBNT2hfw41d |
| Name |
.beta.-D-Glucopyranoside, 2,3,4-tris(acetyloxy)-1-(2-phenyl-2H-1,2,3-triazol-4-yl)butyl, tetraacetate (ester) |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
721.233032172 u |
| Formula |
C32H39N3O16 |
| InChI |
InChI=1S/C32H39N3O16/c1-16(36)43-14-25(45-18(3)38)28(46-19(4)39)27(24-13-33-35(34-24)23-11-9-8-10-12-23)51-32-31(49-22(7)42)30(48-21(6)41)29(47-20(5)40)26(50-32)15-44-17(2)37/h8-13,25-32H,14-15H2,1-7H3 |
| InChIKey |
BFRHXQAVZLQAPS-UHFFFAOYSA-N |
| Molecular Weight |
721.669 g/mol |
| SMILES |
C=1C(=NN(N1)C1=CC=CC=C1)C(O[C@@]1(O[C@@]([C@]([C@@]([C@]1(OC(C)=O)[H])(OC(C)=O)[H])(OC(C)=O)[H])(COC(C)=O)[H])[H])C(C(COC(C)=O)OC(C)=O)OC(C)=O |
