| SpectraBase Spectrum ID |
JJe1LknCoUt |
| Name |
beta-D-Glucopyranoside, 1-propyl-1H-benzimidazol-2-yl 2-(acetylamino)-2-deoxy-1-thio-, 3,4,6-triacetate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
521.183186136 u |
| Formula |
C24H31N3O8S |
| InChI |
InChI=1S/C24H31N3O8S/c1-6-11-27-18-10-8-7-9-17(18)26-24(27)36-23-20(25-13(2)28)22(34-16(5)31)21(33-15(4)30)19(35-23)12-32-14(3)29/h7-10,19-23H,6,11-12H2,1-5H3,(H,25,28) |
| InChIKey |
XTKCEVAHHCAADL-UHFFFAOYSA-N |
| Molecular Weight |
521.585 g/mol |
| SMILES |
N(C1C(SC2=NC=3C=CC=CC3N2CCC)OC(C(OC(=O)C)C1OC(=O)C)COC(=O)C)C(=O)C |
