| SpectraBase Spectrum ID |
KTiCft0kHuC |
| Name |
9-[5-o-(2-Acetoxyisobutyryl)-2,3-dideoxy-2-o-acetyl-3-bromo]inosine |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
500.054276644 u |
| Formula |
C18H21BrN4O8 |
| InChI |
InChI=1S/C18H21BrN4O8/c1-8(24)29-13-11(19)10(5-28-17(27)18(3,4)31-9(2)25)30-16(13)23-7-22-12-14(23)20-6-21-15(12)26/h6-7,10-11,13,16H,5H2,1-4H3,(H,20,21,26) |
| InChIKey |
DKYLRERPKZUKKR-UHFFFAOYSA-N |
| Molecular Weight |
501.290 g/mol |
| SMILES |
C1=2N(C=NC2C(=O)NC=N1)C1C(C(Br)C(O1)COC(C(OC(=O)C)(C)C)=O)OC(=O)C |
![9-[5-o-(2-Acetoxyisobutyryl)-2,3-dideoxy-2-o-acetyl-3-bromo]inosine](/api/spectrum/KTiCft0kHuC/structure.png?h=300&w=458 "9-[5-o-(2-Acetoxyisobutyryl)-2,3-dideoxy-2-o-acetyl-3-bromo]inosine")
