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

ChEBI IDCHEBI:42896
ChEBI Name1-thio-β-D-glucopyranose
Stars
ASCII Name1-thio-beta-D-glucopyranose
DefinitionA thiosugar that is β-D-glucopyranose in which the hydroxy group at position 1 is replaced by a sulfanyl group
Last Modified7 March 2017
DownloadsMolfile
FormulaC6H12O5S
Net Charge0
Average Mass196.224
Monoisotopic Mass196.04054
SMILESOC[C@H]1O[C@@H](S)[C@H](O)[C@@H](O)[C@@H]1O
InChIInChI=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
InChIKeyJUSMHIGDXPKSID-DVKNGEFBSA-N
ChEBI Ontology
Outgoing Relation(s)
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 Relation(s)
β-D-thioglucoside (CHEBI:136440) has functional parent 1-thio-β-D-glucopyranose (CHEBI:42896)
IUPAC Name 
1-thio-β-D-glucopyranosese
Synonyms  Source
β-D-Glcp-SHChEBI
β-D-Glc-SHChEBI
1-thio-β-D-glucoseMetaCyc
1-thio-b-D-glucoseMetaCyc
Manual XrefsDatabases
GS1PDBeChem
CPD-3742MetaCyc
Registry NumbersSources
Reaxys:1723637Reaxys