3-benzyl-5-(2-methylpropyl)-1,2,4-trithiolane (CHEBI:203510)

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CHEBI:203510 - 3-benzyl-5-(2-methylpropyl)-1,2,4-trithiolane

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ChEBI ID	CHEBI:203510
ChEBI Name	3-benzyl-5-(2-methylpropyl)-1,2,4-trithiolane
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C13H18S3
Net Charge	0
Average Mass	270.488
Monoisotopic Mass	270.05706
SMILES	CC(C)CC1SSC(Cc2ccccc2)S1
InChI	InChI=1S/C13H18S3/c1-10(2)8-12-14-13(16-15-12)9-11-6-4-3-5-7-11/h3-7,10,12-13H,8-9H2,1-2H3
InChIKey	IHZLJRZHIFURCV-UHFFFAOYSA-N

Species of Metabolite	Component	Source	Comments
Thermococcus (ncbitaxon:2263)	-	DOI (10.1002/jlac.1993199301138)

ChEBI Ontology

Outgoing Relation(s)
	3-benzyl-5-(2-methylpropyl)-1,2,4-trithiolane (CHEBI:203510) is a benzenes (CHEBI:22712)

IUPAC Name
3-benzyl-5-(2-methylpropyl)-1,2,4-trithiolane

Manual Xrefs	Databases
10475728	ChemSpider