SpectraBase Spectrum ID |
EJ40OEN9Jf4 |
Name |
2-Bromo-6-chloro-9.beta.-(2',3',5'-tri-O-acetyl)-D-ribofuranosylpurine |
Alternate Name(s) |
[(2R,3R,4R)-3,4-bis(acetyloxy)-5-(2-bromo-6-chloro-9H-purin-9-yl)oxolan-2-yl]methyl acetate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C16H16BrClN4O7 |
InChI |
InChI=1S/C16H16BrClN4O7/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 |
FALQPDDXFMGVNW-FJFSNTMWSA-N |
Molecular Weight |
491.682 g/mol |
SMILES |
c12[n](cnc2c(Cl)nc(n1)Br)C1[C@@]([C@](OC(=O)C)([C@](O1)(COC(=O)C)[H])[H])(OC(=O)C)[H] |
SPLASH |
splash10-000j-6970000000-54006afb93aa1ec615d1 |
Source of Spectrum |
SO-0-671-5 |
Wiley ID |
1537823 |