Name: 1-thio-β-D-Glucose (sodium salt)
Rating: 5 (10 reviews)

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HIT ID:HIT212033460
Cas No:10593-29-0
常用名:1-thio-β-D-Glucose (sodium salt)
常用名:1-thio-β-D-Glucose (sodium salt)
IUPAC:sodium [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanide
IUPAC:sodium [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanide
InChI key:VKPBZIVFRYLHPT-WNFIKIDCSA-M

分子式:C6H11NaO5S
分子量:218.2
氢键供体数 (HBD):4
氢键受体数 (HBA):5
LogP:-1.9654307
SMILES:[Na+].OC[C@H]1O[C@@H]([S-])[C@H](O)[C@@H](O)[C@@H]1O
SMILES:[Na+].OC[C@H]1O[C@@H]([S-])[C@H](O)[C@@H](O)[C@@H]1O

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.

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