| SpectraBase Compound ID | AHtYU6DCjXo |
|---|---|
| InChI | InChI=1S/C18H23N3O9S2/c1-8(22)26-6-12-13(27-9(2)23)14(28-10(3)24)15(29-11(4)25)16(30-12)21-7-19-17(32-5)20-18(21)31/h7,12-16H,6H2,1-5H3/t12-,13-,14+,15-,16-/m1/s1 |
| InChIKey | NOLOLLVUPVLKTM-IBEHDNSVSA-N |
| Mol Weight | 489.51 g/mol |
| Molecular Formula | C18H23N3O9S2 |
| Exact Mass | 489.087572 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7Gf1pVKg5QM |
|---|---|
| Name | 1-(2,3,4,6-Tetra-O-acetyl-.beta.,D-glucopyranosyl)-4-methylsulfanyl-1,3,5-triazine-2(1H)-thione |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H23N3O9S2 |
| InChI | InChI=1S/C18H23N3O9S2/c1-8(22)26-6-12-13(27-9(2)23)14(28-10(3)24)15(29-11(4)25)16(30-12)21-7-19-17(32-5)20-18(21)31/h7,12-16H,6H2,1-5H3/t12-,13-,14+,15-,16-/m1/s1 |
| InChIKey | NOLOLLVUPVLKTM-IBEHDNSVSA-N |
| Molecular Weight | 489.514 g/mol |
| SMILES | [C@@]1(N2C(N=C(N=C2)SC)=S)([C@@]([C@@](OC(=O)C)([C@@]([C@](O1)(COC(=O)C)[H])(OC(=O)C)[H])[H])(OC(=O)C)[H])[H] |
| SPLASH | splash10-00ko-9542000000-faccc24494ea051aa8dd |
| Source of Spectrum | F4-40-3456-5a |
| Synonyms | Acetic acid [(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-[4-(methylthio)-2-sulfanylidene-1,3,5-triazin-1-yl]-2-oxanyl]methyl ester [(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-(4-methylsulfanyl-2-sulfanylidene-1,3,5-triazin-1-yl)oxan-2-yl]methyl acetate [(2R,3R,4S,5R,6R)-3,4,5-triacetoxy-6-(4-methylsulfanyl-2-thioxo-1,3,5-triazin-1-yl)tetrahydropyran-2-yl]methyl acetate [(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-(4-methylsulfanyl-2-sulfanylidene-1,3,5-triazin-1-yl)oxan-2-yl]methyl ethanoate |
| Wiley ID | 1671325 |