| SpectraBase Spectrum ID |
JpfvWpyyaas |
| Name |
7-[5-o-(2-Acetoxyisobutyryl)-2,3-dideoxy-2-o-acetyl-3-bromo]pyrrolo[2,3-D]pyrimidine |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
498.075012090 u |
| Formula |
C19H23BrN4O7 |
| InChI |
InChI=1S/C19H23BrN4O7/c1-9(25)29-14-13(20)12(7-28-18(27)19(3,4)31-10(2)26)30-17(14)24-6-5-11-15(21)22-8-23-16(11)24/h5-6,8,12-14,17H,7H2,1-4H3,(H2,21,22,23) |
| InChIKey |
HYEMXPRQEWXTNR-UHFFFAOYSA-N |
| Molecular Weight |
499.318 g/mol |
| SMILES |
C1(N2C3=C(C(N)=NC=N3)C=C2)C(C(Br)C(O1)COC(C(OC(=O)C)(C)C)=O)OC(=O)C |
![7-[5-o-(2-Acetoxyisobutyryl)-2,3-dideoxy-2-o-acetyl-3-bromo]pyrrolo[2,3-D]pyrimidine](/api/spectrum/JpfvWpyyaas/structure.png?h=300&w=458 "7-[5-o-(2-Acetoxyisobutyryl)-2,3-dideoxy-2-o-acetyl-3-bromo]pyrrolo[2,3-D]pyrimidine")
