SpectraBase Compound ID | 7erddFhxLwN |
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InChI | InChI=1S/C12H16N4O4S/c1-2-21-11-7-10(13-4-14-11)16(5-15-7)12-9(19)8(18)6(3-17)20-12/h4-6,8-9,12,17-19H,2-3H2,1H3 |
InChIKey | SXDRPWJMWHDCLL-UHFFFAOYSA-N |
Mol Weight | 312.34 g/mol |
Molecular Formula | C12H16N4O4S |
Exact Mass | 312.089226 g/mol |
SpectraBase Spectrum ID | 9keo9gRH2A9 |
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Name | 6-Ethylthiopurine riboside |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 312.089226181 u |
Formula | C12H16N4O4S |
InChI | InChI=1S/C12H16N4O4S/c1-2-21-11-7-10(13-4-14-11)16(5-15-7)12-9(19)8(18)6(3-17)20-12/h4-6,8-9,12,17-19H,2-3H2,1H3 |
InChIKey | SXDRPWJMWHDCLL-UHFFFAOYSA-N |
Molecular Weight | 312.344 g/mol |
SMILES | C1(=NC=NC=2N(C=NC12)C1C(C(C(O1)CO)O)O)SCC |