| SpectraBase Spectrum ID |
J57Dxh4J2f1 |
| Name |
1-[2-deoxy-.beta.-(diacetyl)ribofuranosyl]-N(3)-pentafluorobenzyl-5-methyluracyl |
| Alternate Name(s) |
Deoxythymidine-diacetyl, pentafluorobenzyl derivative
[(2R,5R)-3-(acetyloxy)-5-{5-methyl-2,4-dioxo-3-[(2,3,4,5,6-pentafluorophenyl)methyl]-1,2,3,4-tetrahydropyrimidin-1-yl}oxolan-2-yl]methyl acetate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H19F5N2O7 |
| InChI |
InChI=1S/C21H19F5N2O7/c1-8-5-27(14-4-12(34-10(3)30)13(35-14)7-33-9(2)29)21(32)28(20(8)31)6-11-15(22)17(24)19(26)18(25)16(11)23/h5,12-14H,4,6-7H2,1-3H3/t12?,13-,14-/m1/s1 |
| InChIKey |
HVQOEESGSBOPQD-ILMHWDKJSA-N |
| Molecular Weight |
506.382 g/mol |
| SMILES |
C1(N(C(C(=CN1[C@@]1(O[C@](COC(=O)C)(C(C1)OC(=O)C)[H])[H])C)=O)Cc1c(c(F)c(c(c1F)F)F)F)=O |
| SPLASH |
splash10-001i-9011000000-71b9181c6890f2b9a92d |
| Source of Spectrum |
KO-21-445-0 |
| Wiley ID |
1399769 |
![1-[2-deoxy-.beta.-(diacetyl)ribofuranosyl]-N(3)-pentafluorobenzyl-5-methyluracyl](/api/spectrum/J57Dxh4J2f1/structure.png?h=300&w=458 "1-[2-deoxy-.beta.-(diacetyl)ribofuranosyl]-N(3)-pentafluorobenzyl-5-methyluracyl")
