10593-29-0,1-Thio-β-D-glucose sodium salt,
CAS: 10593-29-0
C6H11NaO5S / 218.2
MFCD00061630
1-硫代-beta-D-葡萄糖钠盐,
1-thio-β-D-Glucose is an analog of β-D-glucose in which sulfur replaces the hydroxyl group at the one position. The thiol group allows diverse chemical reactions, including click chemistry and polymerization. 1-thio-β-D-Glucose can be labeled with technetium-99m for analytical and diagnostic procedures. It can also be used as a substrate for glucose oxidase, which leads to the production of 1-thio-β-D-gluconic acid.
CAS Number | 10593-29-0 |
Product Name | Sodium (2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-thiolate |
IUPAC Name | sodium;(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxane-2-thiolate |
Molecular Formula | C6H11NaO5S |
Molecular Weight | 218.2 g/mol |
InChI | InChI=1S/C6H12O5S.Na/c7-1-2-3(8)4(9)5(10)6(12)11-2;/h2-10,12H,1H2;/q;+1/p-1/t2-,3-,4+,5-,6+;/m1./s1 |
InChI Key | VKPBZIVFRYLHPT-WNFIKIDCSA-M |
SMILES | C(C1C(C(C(C(O1)[S-])O)O)O)O.[Na+] |
Synonyms | 1-thio-beta-D-glucose, 1-thioglucose, 1-thioglucose, (D)-isomer, 1-thioglucose, sodium salt, beta-D-thioglucose, sodium thioglucse |
Canonical SMILES | C(C1C(C(C(C(O1)[S-])O)O)O)O.[Na+] |
Isomeric SMILES | C([C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)[S-])O)O)O)O.[Na+] |
COA:
Product name: Beta-D-Thioglucose sodium salt
M.F.: C6H11NaO5S M.W.: 218.2 CAS: 10593-29-0
Items | Standards | Results |
Appearance | White powder | Complies |
Solubility | Easily soluble in water, insoluble in CHCl3 | Complies |
NMR and MS | Should comply | Complies |
Identification | IR and HPLC | Complies |
Heavy metal | Max.50ppm | Complies |
TLC | Should be one spot | One spot |
Assay by NMR | Min. 98% | Complies |
References:
1. Fleet G, et al., Biochemistry 1994, 33, 5745-5758
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