| SpectraBase Spectrum ID |
1V3yqzyAXP5 |
| Name |
2-Methylthio-6-deoxy-9.beta.,D-glycopyranosylpurin-6(1H)-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H14N4O5S |
| InChI |
InChI=1S/C11H14N4O5S/c1-21-11-13-8-5(9(19)14-11)12-3-15(8)10-7(18)6(17)4(16)2-20-10/h3-4,6-7,10,16-18H,2H2,1H3,(H,13,14,19)/t4-,6-,7?,10+/m0/s1 |
| InChIKey |
GBYNCABPYXTMHP-YRMVKQEOSA-N |
| Molecular Weight |
314.316 g/mol |
| SMILES |
O[C@]1([C@](CO[C@](C1O)([n]1c2c(nc1)C(=O)NC(=N2)SC)[H])(O)[H])[H] |
| SPLASH |
splash10-001i-0900000000-2da8239779f0b89bb082 |
| Source of Spectrum |
SO-0-492-2 |
| Wiley ID |
1543126 |
