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CHEBI:167086 - Methyl pentyl disulfide

Default Structure
ChEBI IDCHEBI:167086
ChEBI NameMethyl pentyl disulfide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC6H14S2
Net Charge0
Average Mass150.312
Monoisotopic Mass150.05369
SMILESCCCCCSSC
InChIInChI=1S/C6H14S2/c1-3-4-5-6-8-7-2/h3-6H2,1-2H3
InChIKeyVDJXDNLYBDHPHP-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Tuber magnatum (ncbitaxon:42249) fruit body (BTO:0000487) MetaboLights (MTBLS808) Strain: Tuber magnatum Pico
ChEBI Ontology
Outgoing Relation(s)
Methyl pentyl disulfide (CHEBI:167086) is a organic disulfide (CHEBI:35489)
IUPAC Name 
1-(methyldisulanyl)pentane
Manual XrefsDatabases
455742ChemSpider
HMDB0031161HMDB
Registry NumbersSources
CAS:72437-68-4ChemIDplus