CHEBI:42896 - 1-thio-β-D-glucopyranose

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ChEBI Name 1-thio-β-D-glucopyranose
ChEBI ID CHEBI:42896
ChEBI ASCII Name 1-thio-beta-D-glucopyranose
Definition A thiosugar that is β-D-glucopyranose in which the hydroxy group at position 1 is replaced by a sulfanyl group
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C6H12O5S
Net Charge 0
Average Mass 196.22100
Monoisotopic Mass 196.04054
InChI InChI=1S/C6H12O5S/c7-1-2-3(8)4(9)5(10)6(12)11-2/h2-10,12H,1H2/t2-,3-,4+,5-,6+/m1/s1
InChIKey JUSMHIGDXPKSID-DVKNGEFBSA-N
SMILES OC[C@H]1O[C@@H](S)[C@H](O)[C@@H](O)[C@@H]1O
ChEBI Ontology
Outgoing 1-thio-β-D-glucopyranose (CHEBI:42896) has functional parent β-D-glucose (CHEBI:15903)
1-thio-β-D-glucopyranose (CHEBI:42896) is a monosaccharide derivative (CHEBI:63367)
1-thio-β-D-glucopyranose (CHEBI:42896) is a thiol (CHEBI:29256)
1-thio-β-D-glucopyranose (CHEBI:42896) is a thiosugar (CHEBI:73754)
Incoming β-D-thioglucoside (CHEBI:136440) has functional parent 1-thio-β-D-glucopyranose (CHEBI:42896)
IUPAC Name
1-thio-β-D-glucopyranosese
Synonyms Sources
1-thio-b-D-glucose MetaCyc
1-thio-β-D-glucose MetaCyc
β-D-Glc-SH ChEBI
β-D-Glcp-SH ChEBI
Manual Xrefs Databases
CPD-3742 MetaCyc
GS1 PDBeChem
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Registry Number Type Source
1723637 Reaxys Registry Number Reaxys
Last Modified
07 March 2017