| SpectraBase Spectrum ID |
4HVNfyvpaUt |
| Name |
1H-Imidazole, 5-bromo-4-nitro-1-(2,3,4,6-tetra-o-acetyl-.beta.-D-glucopyranosyl)- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
521.028121465 u |
| Formula |
C17H20BrN3O11 |
| InChI |
InChI=1S/C17H20BrN3O11/c1-7(22)28-5-11-12(29-8(2)23)13(30-9(3)24)14(31-10(4)25)17(32-11)20-6-19-16(15(20)18)21(26)27/h6,11-14,17H,5H2,1-4H3/t11-,12-,13+,14-,17-/m1/s1 |
| InChIKey |
BWILKAMFHFQTMU-GODIYZJISA-N |
| Molecular Weight |
522.261 g/mol |
| SMILES |
[C@@]1(N2C(=C(N(=O)=O)N=C2)Br)([C@@]([C@@](OC(=O)C)([C@@]([C@](O1)(COC(=O)C)[H])(OC(=O)C)[H])[H])(OC(=O)C)[H])[H] |
