| SpectraBase Spectrum ID |
7VDUhG50AVY |
| Name |
9H-Purine, 2-bromo-6-fluoro-9-(2,3,5-tri-O-acetyl-.beta.-D-ribofuranosyl)- |
| Alternate Name(s) |
9-(2,3,5-tri-O-acetyl-.beta.-D-ribofuranosyl)-2-bromo-6-fluoro-purine
[(2R,3R,4R,5R)-3,4-bis(acetyloxy)-5-(2-bromo-6-fluoro-9H-purin-9-yl)oxolan-2-yl]methyl acetate |
| CAS Registry Number |
79999-44-3 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H16BrFN4O7 |
| InChI |
InChI=1S/C16H16BrFN4O7/c1-6(23)26-4-9-11(27-7(2)24)12(28-8(3)25)15(29-9)22-5-19-10-13(18)20-16(17)21-14(10)22/h5,9,11-12,15H,4H2,1-3H3/t9-,11-,12-,15-/m1/s1 |
| InChIKey |
ZJACYZGCUYQVKD-SDBHATRESA-N |
| Molecular Weight |
475.227 g/mol |
| SMILES |
c12[n](cnc2c(F)nc(n1)Br)[C@]1([C@@]([C@](OC(=O)C)([C@](O1)(COC(=O)C)[H])[H])(OC(=O)C)[H])[H] |
| SPLASH |
splash10-0a4i-0090000000-e4a208451bb303120c63 |
| Source of Spectrum |
I-59-2611-0 |
| Wiley ID |
1393730 |
