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CHEBI:194397 - n-Octyl-beta-D-thioglucopyranoside

ChEBI IDCHEBI:194397
ChEBI Namen-Octyl-beta-D-thioglucopyranoside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H28O5S
Net Charge0
Average Mass308.440
Monoisotopic Mass308.16574
SMILESCCCCCCCCS[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
InChIInChI=1S/C14H28O5S/c1-2-3-4-5-6-7-8-20-14-13(18)12(17)11(16)10(9-15)19-14/h10-18H,2-9H2,1H3/t10-,11-,12+,13-,14+/m1/s1
InChIKeyCGVLVOOFCGWBCS-RGDJUOJXSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) cerebral cortex (BTO:0000233) MetaboLights (MTBLS6578)
ChEBI Ontology
Outgoing Relation(s)
n-Octyl-beta-D-thioglucopyranoside (CHEBI:194397) is a S-glycosyl compound (CHEBI:35275)
IUPAC Name 
(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-octylsulanyloxane-3,4,5-triol
Manual XrefsDatabases
571158ChemSpider