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CHEBI:172319 - 1,8-Octanedithiol

ChEBI IDCHEBI:172319
ChEBI Name1,8-Octanedithiol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC8H18S2
Net Charge0
Average Mass178.366
Monoisotopic Mass178.08499
SMILESSCCCCCCCCS
InChIInChI=1S/C8H18S2/c9-7-5-3-1-2-4-6-8-10/h9-10H,1-8H2
InChIKeyPGTWZHXOSWQKCY-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
blood plasma (BTO:0000131) MetaboLights (MTBLS2128)
Pooled sample (NCIT:C45910) MetaboLights (MTBLS2128)
ChEBI Ontology
Outgoing Relation(s)
1,8-Octanedithiol (CHEBI:172319) is a alkanethiol (CHEBI:47908)
IUPAC Name 
octane-1,8-dithiol
Manual XrefsDatabases
13838ChemSpider
HMDB0040348HMDB
Registry NumbersSources
CAS:1191-62-4ChemIDplus