| SpectraBase Spectrum ID |
7pqMlXdJdPS |
| Name |
7H-Purine, 7-.beta.-D-glucofuranosyl-6-(methylthio)- |
| CAS Registry Number |
56198-93-7 |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H16N4O5S |
| InChI |
InChI=1S/C12H16N4O5S/c1-22-11-6-10(13-3-14-11)15-4-16(6)12-8(20)7(19)9(21-12)5(18)2-17/h3-5,7-9,12,17-20H,2H2,1H3/t5-,7-,8-,9-,12-/m1/s1 |
| InChIKey |
PTPZWKKUQLVYIT-PXYVEVNBSA-N |
| Molecular Weight |
328.343 g/mol |
| SMILES |
O[C@@]1([C@]([C@@](O[C@@]1([C@@](CO)(O)[H])[H])([n]1c2c(ncnc2SC)nc1)[H])(O)[H])[H] |
| SPLASH |
splash10-014i-3900000000-20f96406a0d68f35de4e |
| Source of Spectrum |
B-31-1109-0 |
| Synonyms |
(2R,3R,4R,5R)-2-[(1R)-1,2-dihydroxyethyl]-5-[6-(methylsulfanyl)-7H-purin-7-yl]oxolane-3,4-diol
6-Methylthio-7-.beta.-D-glucofuranosylpurine |
| Wiley ID |
1325879 |
