| SpectraBase Spectrum ID |
4QkcDyH0C0 |
| Name |
1H-Imidazole-5-carbonitrile, 4-amino-1-(2,3,4,6-tetra-O-acetyl-.beta.-D-glucopyranosyl)- |
| Alternate Name(s) |
4-Amino-5-cyano-1-(tetra-O-acetyl-.beta.-D-glucopyranosyl)imidazole
[(2R,3R,4S,5R,6R)-3,4,5-tris(acetyloxy)-6-(4-amino-5-cyano-1H-imidazol-1-yl)oxan-2-yl]methyl acetate |
| CAS Registry Number |
67010-99-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H22N4O9 |
| InChI |
InChI=1S/C18H22N4O9/c1-8(23)27-6-13-14(28-9(2)24)15(29-10(3)25)16(30-11(4)26)18(31-13)22-7-21-17(20)12(22)5-19/h7,13-16,18H,6,20H2,1-4H3/t13-,14-,15+,16-,18-/m1/s1 |
| InChIKey |
PYQHXQSZYJUBHZ-XLKGFZLASA-N |
| Molecular Weight |
438.393 g/mol |
| SMILES |
Nc1c([n]([C@]2([C@@]([C@@](OC(=O)C)([C@@]([C@](O2)(COC(=O)C)[H])(OC(=O)C)[H])[H])(OC(=O)C)[H])[H])cn1)C#N |
| SPLASH |
splash10-066x-4901000000-6fc9414706cd42393eb0 |
| Source of Spectrum |
B-31-1110-0 |
| Wiley ID |
1383997 |
