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N-(β-D-Glucopyranosyl)-N′-[(2-methanethiosulfonyl)ethyl] Urea , CAS No.550325-52-5
Basic Description
Synonyms | N-(beta-D-Glucopyranosyl)-N'-[(2-methanethiosulfonyl)ethyl] Urea | DTXSID70747854 | N-({2-[(Methanesulfonyl)sulfanyl]ethyl}carbamoyl)-beta-D-threo-hexopyranosylamine | 1-(2-methylsulfonylsulfanylethyl)-3-[(2R,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan- |
Storage Temp | Store at -20°C |
Shipped In | Ice chest + Ice pads |
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Names and Identifiers
IUPAC Name | 1-(2-methylsulfonylsulfanylethyl)-3-[(2R,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]urea |
INCHI | InChI=1S/C10H20N2O8S2/c1-22(18,19)21-3-2-11-10(17)12-9-8(16)7(15)6(14)5(4-13)20-9/h5-9,13-16H,2-4H2,1H3,(H2,11,12,17)/t5?,6-,7+,8?,9-/m1/s1 |
InChi Key | UHSWDDMEGXWJSC-WUSGRAFWSA-N |
Canonical SMILES | CS(=O)(=O)SCCNC(=O)NC1C(C(C(C(O1)CO)O)O)O |
Isomeric SMILES | CS(=O)(=O)SCCNC(=O)N[C@H]1C([C@H]([C@@H](C(O1)CO)O)O)O |
PubChem CID | 71317087 |
Molecular Weight | 360.4 |
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Chemical and Physical Properties
Solubility | Soluble in Methanol |
Melt Point(°C) | 152-154°C (lit.)(dec.) |
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